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IONS BEGIN IONS TITLE=CCMSLIB00005720957 PEPMASS=724.526 CHARGE=1 MSLEVEL=2 FRAGMENTATION_METHOD=N/A COLLISION_ENERGY=20.0 SOURCE_INSTRUMENT=LC-ESI-qTof FILENAME=2612787b7969416f8985aa977b8fc3e7/ESI-_20-40eV_HCE_20M_2.mzXML SEQ=*..* IONMODE=Negative ORGANISM=HCE-CELL-LYSATE-LIPIDS NAME=PE(O-16:0_20:4) - 1-(((2-aminoethoxy)(hydroxy)phosphoryl)oxy)-3-(hexadecyloxy)propan-2-yl-icosa-5.8.11.14-tetraenoate [M-H]- PI=O Laprevote DATACOLLECTOR=C-TAC SMILES=[C@](COP(=O)(O)OCCN)([H])(OC(CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)=O)COCCCCCCCCCCCCCCCC INCHI=InChI=1S/C41H76NO7P/c1-3-5-7-9-11-13-15-17-19-20-21-22-24-26-28-30-32-34-41(43)49-40(39-48-50(44,45)47-37-35-42)38-46-36-33-31-29-27-25-23-18-16-14-12-10-8-6-4-2/h11,13,17,19,21-22,26,28,40H,3-10,12,14-16,18,20,23-25,27,29-39,42H2,1-2H3,(H,44,45)/b13-11-,19-17-,22-21-,28-26-/t40-/m1/s1 INCHIAUX=YGQNJBFCFNPRKR-FHXSHDTFSA-N PUBMED=N/A SUBMITUSER=mpanitchpakdi LIBRARYQUALITY=3 SPECTRUMID=CCMSLIB00005720957 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