MassBank Record: KO002119



 4-Aminobenzoic acid; LC-ESI-QQ; MS2; CE:20 V; [M+H]+ 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KO002119
RECORD_TITLE: 4-Aminobenzoic acid; LC-ESI-QQ; MS2; CE:20 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 A043

CH$NAME: p-Aminobenzoate CH$NAME: 4-Aminobenzoic acid CH$NAME: 4-Aminobenzoate CH$NAME: ABEE CH$COMPOUND_CLASS: N/A CH$FORMULA: C7H7NO2 CH$EXACT_MASS: 137.04768 CH$SMILES: Nc(c1)ccc(c1)C(O)=O CH$IUPAC: InChI=1S/C7H7NO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,8H2,(H,9,10) CH$LINK: CAS 150-13-0 CH$LINK: CHEBI 30753 CH$LINK: CHEMPDB PAB CH$LINK: KEGG C00568 CH$LINK: NIKKAJI J5.852A CH$LINK: PUBCHEM SID:3847
AC$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 20 V
MS$FOCUSED_ION: PRECURSOR_M/Z 138 MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-00di-1900000000-e4d34d9516fe889137f6 PK$NUM_PEAK: 18 PK$PEAK: m/z int. rel.int. 45.100 69307.0 7 57.000 19802.0 2 59.200 683169.0 74 60.700 24752.5 3 61.000 207921.0 22 77.200 123762.5 13 80.100 138614.0 15 85.000 19802.0 2 89.200 371287.5 40 91.300 39604.0 4 91.900 29703.0 3 93.000 212871.5 23 94.200 306931.0 33 102.900 163366.5 18 120.000 678218.5 73 121.300 9282187.5 999 122.400 24752.5 3 137.900 222772.5 24 //