MassBank Record: JP012242



 BENZENE; CI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP012242
RECORD_TITLE: BENZENE; CI-B; MS
DATE: 2016.01.19 (2008.10.21, 2011.05.06)
AUTHORS: IIDA YFAC. OF ENGINEERING, SEIKEI UNIV., DAISHIMA SFAC. OF ENGINEERING, SEIKEI UNIV., FAC. OF ENGINEERING, SEIKEI UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: BENZENE CH$COMPOUND_CLASS: N/A CH$FORMULA: C6H6 CH$EXACT_MASS: 78.04695 CH$SMILES: c(c1)cccc1 CH$IUPAC: InChI=1S/C6H6/c1-2-4-6-5-3-1/h1-6H CH$LINK: CAS 71-43-2 CH$LINK: INCHIKEY UHOVQNZJYSORNB-UHFFFAOYSA-N
AC$INSTRUMENT: FINNIGAN-MAT 4500 AC$INSTRUMENT_TYPE: CI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 120 eV AC$MASS_SPECTROMETRY: REAGENT_GAS METHANE
PK$SPLASH: splash10-004i-9100000000-11f8463e7c6286637b1b PK$NUM_PEAK: 7 PK$PEAK: m/z int. rel.int. 78 7.43 74 79 99.99 999 80 7.03 70 91 3.35 34 107 13.88 139 108 1.2 12 119 4.49 45 //