MassBank Record: JP004995



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

ACCESSION: JP004995
RECORD_TITLE: M-CHLOROTOLUENE; EI-B; MS
DATE: 2016.01.19 (2008.10.21, 2011.05.06)
AUTHORS: , MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

CH$NAME: M-CHLOROTOLUENE CH$COMPOUND_CLASS: N/A CH$FORMULA: C7H7Cl CH$EXACT_MASS: 126.02363 CH$SMILES: Cc(c1)cc(Cl)cc1 CH$IUPAC: InChI=1S/C7H7Cl/c1-6-3-2-4-7(8)5-6/h2-5H,1H3 CH$LINK: CAS 108-41-8 CH$LINK: INCHIKEY OSOUNOBYRMOXQQ-UHFFFAOYSA-N
AC$INSTRUMENT: JEOL JMS-D-3000 AC$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$SPLASH: splash10-002f-9400000000-c49525ddb410ce828d26 PK$NUM_PEAK: 23 PK$PEAK: m/z int. rel.int. 43 1.58 16 44 1.77 18 45 7.61 76 50 3.31 33 51 3.49 35 61 1.58 16 62 3.44 34 63 9.38 94 64 2.07 21 65 8.2 82 73 2.17 22 74 1.14 11 75 2.31 23 89 7.96 80 90 2.73 27 91 99.99 999 92 7.87 79 99 2.22 22 125 12.23 122 126 41.39 414 127 7.17 72 128 13.46 135 129 1.01 10 //