MassBank Record: KO001630



 Palmitoleic acid; LC-ESI-QQ; MS2; CE:50 V; [M-H]- 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KO001630
RECORD_TITLE: Palmitoleic acid; LC-ESI-QQ; MS2; CE:50 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 50 V
MS$FOCUSED_ION: PRECURSOR_M/Z 253 MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
PK$SPLASH: splash10-004j-9000000000-fb5a2e21c48a7d72aac8 PK$NUM_PEAK: 4 PK$PEAK: m/z int. rel.int. 45.200 49505.0 526 70.700 39604.0 421 79.000 94059.5 999 97.000 24752.5 263 //