MassBank Record: KO003127



 5-Hydroxyindoleacetic 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: KO003127
RECORD_TITLE: 5-Hydroxyindoleacetic 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 H057

CH$NAME: 5-Hydroxy-3-indoleaceacetate CH$NAME: 5-Hydroxyindoleacetate CH$NAME: 5-Hydroxyindoleacetic acid CH$COMPOUND_CLASS: N/A CH$FORMULA: C10H9NO3 CH$EXACT_MASS: 191.05824 CH$SMILES: C1=CC2=C(C=C1O)C(=CN2)CC(=O)O CH$IUPAC: InChI=1S/C10H9NO3/c12-7-1-2-9-8(4-7)6(5-11-9)3-10(13)14/h1-2,4-5,11-12H,3H2,(H,13,14) CH$LINK: KEGG C05635 CH$LINK: PUBCHEM SID:7946
AC$INSTRUMENT: API3000, Applied Biosystems AC$INSTRUMENT_TYPE: LC-ESI-QQ AC$MASS_SPECTROMETRY: MS_TYPE MS2 AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: COLLISION_ENERGY 50 V
MS$FOCUSED_ION: PRECURSOR_M/Z 192 MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-0006-9400000000-0fd99ccea1ed33b42bfa PK$NUM_PEAK: 15 PK$PEAK: m/z int. rel.int. 55.400 69307.0 318 65.200 69307.0 318 65.700 39604.0 182 72.700 29703.0 136 79.300 24752.5 114 80.100 14851.5 68 91.000 148515.0 681 92.000 217822.0 999 103.200 19802.0 91 105.200 84158.5 386 107.200 24752.5 114 117.300 49505.0 227 128.400 14851.5 68 134.300 59406.0 272 141.500 39604.0 182 //