MassBank Record: KO000332



 Benzimidazole; 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: KO000332
RECORD_TITLE: Benzimidazole; 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 B007

CH$NAME: Benzimidazole CH$COMPOUND_CLASS: N/A CH$FORMULA: C7H6N2 CH$EXACT_MASS: 118.05310 CH$SMILES: C1=CC=C2C(=C1)NC=N2 CH$IUPAC: InChI=1S/C7H6N2/c1-2-4-7-6(3-1)8-5-9-7/h1-5H,(H,8,9) CH$LINK: CAS 51-17-2 CH$LINK: CHEBI 3028 CH$LINK: CHEMPDB BZI CH$LINK: KEGG C02009 CH$LINK: NIKKAJI J2.303E CH$LINK: PUBCHEM SID:5105
AC$INSTRUMENT: API3000, Applied Biosystems AC$INSTRUMENT_TYPE: LC-ESI-QQ AC$MASS_SPECTROMETRY: MS_TYPE MS2 AC$MASS_SPECTROMETRY: ION_MODE NEGATIVE AC$MASS_SPECTROMETRY: COLLISION_ENERGY 20 V
MS$FOCUSED_ION: PRECURSOR_M/Z 117 MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
PK$SPLASH: splash10-014i-0900000000-237aaedc281a7c6869af PK$NUM_PEAK: 10 PK$PEAK: m/z int. rel.int. 55.200 74257.5 1 57.000 9901.0 1 59.100 69307.0 1 65.900 24752.5 1 73.200 10722783.0 53 90.000 237624.0 1 99.200 1034654.5 5 116.000 193069.5 1 116.600 11707932.5 58 117.000 201193270.5 999 //