MassBank Record: KO000018



 Anthranilic 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: KO000018
RECORD_TITLE: Anthranilic 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 A010

CH$NAME: Anthranilate CH$NAME: Anthranilic acid CH$NAME: 2-Aminobenzoate CH$NAME: Vitamin L1 CH$NAME: o-Aminobenzoic acid CH$COMPOUND_CLASS: N/A CH$FORMULA: C7H7NO2 CH$EXACT_MASS: 137.04768 CH$SMILES: OC(=O)c(c1)c(N)ccc1 CH$IUPAC: InChI=1S/C7H7NO2/c8-6-4-2-1-3-5(6)7(9)10/h1-4H,8H2,(H,9,10) CH$LINK: CAS 118-92-3 CH$LINK: CHEBI 30754 CH$LINK: CHEMPDB BE2 CH$LINK: KEGG C00108 CH$LINK: NIKKAJI J2.912B CH$LINK: PUBCHEM SID:3408
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 136 MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
PK$SPLASH: splash10-0006-9000000000-94f19baa1ae36f43be60 PK$NUM_PEAK: 7 PK$PEAK: m/z int. rel.int. 40.400 113861.5 39 50.000 128713.0 44 65.000 1198021.0 412 66.200 153465.5 53 75.000 108911.0 37 90.200 336634.0 116 92.300 2905943.5 999 //