MassBank Record: KO000945



 2-Guanidinobenzimidazole; LC-ESI-QQ; MS2; CE:30 V; [M-H]- 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KO000945
RECORD_TITLE: 2-Guanidinobenzimidazole; LC-ESI-QQ; MS2; CE:30 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 G101

CH$NAME: 2-Guanidinobenzimidazole CH$NAME: 2-Benzimidazolylguanidine CH$COMPOUND_CLASS: N/A CH$FORMULA: C8H9N5 CH$EXACT_MASS: 175.08580 CH$SMILES: C1=CC=C2C(=C1)NC(=N2)N=C(N)N CH$IUPAC: InChI=1S/C8H9N5/c9-7(10)13-8-11-5-3-1-2-4-6(5)12-8/h1-4H,(H5,9,10,11,12,13) CH$LINK: CAS 5418-95-1 CH$LINK: KEGG C10898 CH$LINK: NIKKAJI J217.997K CH$LINK: PUBCHEM SID:13081
AC$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 30 V
MS$FOCUSED_ION: PRECURSOR_M/Z 174 MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
PK$SPLASH: splash10-001i-0900000000-e1885935823c1a6e6bc8 PK$NUM_PEAK: 12 PK$PEAK: m/z int. rel.int. 41.000 5826738.5 15 41.900 123762.5 1 58.900 14851.5 1 102.300 29703.0 1 115.400 39604.0 1 129.900 29703.0 1 131.000 500000.5 1 132.100 380926123.5 999 156.800 1965348.5 5 157.400 495050.0 1 159.300 14851.5 1 174.100 29703.0 1 //