MassBank Record: KO002439



 Benzamide; 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: KO002439
RECORD_TITLE: Benzamide; LC-ESI-QQ; MS2; CE:20 V; [M+H]+
DATE: 2016.01.19 (2007.07.07, 2011.05.10)
AUTHORS: Kakazu YInstitute for Advanced Biosciences, Keio Univ., Horai HInstitute for Advanced Biosciences, Keio Univ., Institute for Advanced Biosciences, Keio Univ.
LICENSE: CC BY-NC-SA
COMMENT: KEIO_ID B009

CH$NAME: Benzamide CH$COMPOUND_CLASS: N/A CH$FORMULA: C7H7NO CH$EXACT_MASS: 121.05276 CH$SMILES: NC(=O)c(c1)cccc1 CH$IUPAC: InChI=1S/C7H7NO/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H2,8,9) CH$LINK: CAS 55-21-0 CH$LINK: KEGG C09815 CH$LINK: NIKKAJI J1.374I CH$LINK: PUBCHEM SID:12003 CH$LINK: INCHIKEY KXDAEFPNCMNJSK-UHFFFAOYSA-N
AC$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$FOCUSED_ION: PRECURSOR_M/Z 122 MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-0a6r-8900000000-d40d6a968a8a706e6500 PK$NUM_PEAK: 15 PK$PEAK: m/z int. rel.int. 43.400 54455.5 60 44.900 59406.0 66 53.500 49505.0 55 62.800 39604.0 44 68.900 356436.0 395 76.900 123762.5 137 77.300 19802.0 22 78.800 623763.0 692 86.300 49505.0 55 87.000 99010.0 110 93.700 24752.5 27 104.000 14851.5 16 105.100 900991.0 999 107.300 163366.5 181 122.100 455446.0 505 //