MassBank Record: KO001628



 Palmitoleic acid; LC-ESI-QQ; MS2; CE:30 V; [M-H]- 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KO001628
RECORD_TITLE: Palmitoleic acid; LC-ESI-QQ; MS2; CE:30 V; [M-H]-
DATE: 2016.01.19 (Created 2007.07.07, modified 2011.05.10)
AUTHORS: Kakazu Y, Horai H, Institute for Advanced Biosciences, Keio Univ.
LICENSE: CC BY-NC-SA
COMMENT: KEIO_ID P044

CH$NAME: Palmitoleate CH$NAME: (9Z)-Hexadecenoic acid CH$NAME: cis-9-Hexadecenoic acid CH$NAME: Palmitoleic acid CH$COMPOUND_CLASS: N/A CH$FORMULA: C16H30O2 CH$EXACT_MASS: 254.22458 CH$SMILES: CCCCCCC=CCCCCCCCC(O)=O CH$IUPAC: InChI=1S/C16H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h7-8H,2-6,9-15H2,1H3,(H,17,18)/b8-7- CH$LINK: CAS 373-49-9 CH$LINK: CHEBI 28716 CH$LINK: CHEMPDB PAM CH$LINK: KEGG C08362 CH$LINK: NIKKAJI J12.503B CH$LINK: PUBCHEM SID:10558
AC$INSTRUMENT: API3000, Applied Biosystems AC$INSTRUMENT_TYPE: LC-ESI-QQ AC$MASS_SPECTROMETRY: MS_TYPE MS2 AC$MASS_SPECTROMETRY: ION_MODE NEGATIVE AC$MASS_SPECTROMETRY: COLLISION_ENERGY 30 V
MS$FOCUSED_ION: PRECURSOR_M/Z 253 MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
PK$SPLASH: splash10-0udi-0090000000-e5833c7aa4795570bdc4 PK$NUM_PEAK: 16 PK$PEAK: m/z int. rel.int. 34.800 49505.0 1 46.100 94059.5 1 58.900 64356.5 1 71.100 113861.5 2 78.900 64356.5 1 82.700 24752.5 1 97.000 207921.0 3 111.600 79208.0 1 114.800 64356.5 1 140.800 9901.0 1 149.400 19802.0 1 167.600 14851.5 1 183.400 24752.5 1 220.700 103960.5 2 235.300 212871.5 3 253.300 67514919.0 999 //