MassBank Record: JP001282



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

ACCESSION: JP001282
RECORD_TITLE: META-TOLUOYL CHLORIDE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA

CH$NAME: META-TOLUOYL CHLORIDE CH$NAME: M-METHYLBENZOYL CHLORIDE CH$COMPOUND_CLASS: N/A CH$FORMULA: C8H7ClO CH$EXACT_MASS: 154.01854 CH$SMILES: Cc(c1)cc(cc1)C(=O)Cl CH$IUPAC: InChI=1S/C8H7ClO/c1-6-3-2-4-7(5-6)8(9)10/h2-5H,1H3
AC$INSTRUMENT: HITACHI RMU-7M AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-014l-9600000000-9ae967ad6ad30004b79c PK$NUM_PEAK: 22 PK$PEAK: m/z int. rel.int. 38 1.83 18 39 12.2 122 41 1.65 17 45 1.74 17 45.5 3.58 36 50 4.95 50 51 4.5 45 59 2.11 21 59.5 1.19 12 61 1.01 10 62 3.67 37 63 10.28 103 64 1.74 17 65 22.94 229 89 7.43 74 90 2.84 28 91 72.39 724 92 4.59 46 119 99.99 999 120 7.61 76 154 6.42 64 156 1.74 17 //