MassBank Record: KO001289



 Lauric 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: KO001289
RECORD_TITLE: Lauric 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 L013

CH$NAME: Laurate CH$NAME: Dodecanoic acid CH$NAME: Lauric acid CH$NAME: Dodecylcarboxylate CH$NAME: Dodecanoate CH$COMPOUND_CLASS: N/A CH$FORMULA: C12H24O2 CH$EXACT_MASS: 200.17763 CH$SMILES: CCCCCCCCCCCC(O)=O CH$IUPAC: InChI=1S/C12H24O2/c1-2-3-4-5-6-7-8-9-10-11-12(13)14/h2-11H2,1H3,(H,13,14) CH$LINK: CAS 143-07-7 CH$LINK: CHEBI 30805 CH$LINK: CHEMPDB DAO CH$LINK: KEGG C02679 CH$LINK: NIKKAJI J2.548H CH$LINK: PUBCHEM SID:5649
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 199 MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
PK$SPLASH: splash10-0fg2-9000000000-c2f78a8d76b7888c7eaa PK$NUM_PEAK: 7 PK$PEAK: m/z int. rel.int. 37.300 34653.5 699 45.100 49505.0 999 54.500 29703.0 599 74.400 39604.0 799 79.100 24752.5 500 79.300 19802.0 400 96.800 9901.0 200 //