MassBank Record: JP000951



 1,2,4-TRICHLOROBENZENE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP000951
RECORD_TITLE: 1,2,4-TRICHLOROBENZENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KOGA M, UNIV. OF OCCUPATIONAL AND ENVIRONMENTAL HEALTH
LICENSE: CC BY-NC-SA

CH$NAME: 1,2,4-TRICHLOROBENZENE CH$COMPOUND_CLASS: N/A CH$FORMULA: C6H3Cl3 CH$EXACT_MASS: 179.93003 CH$SMILES: Clc(c1)cc(Cl)c(Cl)c1 CH$IUPAC: InChI=1S/C6H3Cl3/c7-4-1-2-5(8)6(9)3-4/h1-3H CH$LINK: CAS 120-82-1
AC$INSTRUMENT: JEOL JMS-01-SG 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: splash10-001i-2900000000-c9cb3f8f606230da9665 PK$NUM_PEAK: 29 PK$PEAK: m/z int. rel.int. 49 3.8 38 50 6.2 62 60 2.3 23 61 0.23 2 72 6.5 65 73 11.4 114 74 21.6 216 75 1.28 13 84 8.4 84 85 3.8 38 86 2.9 29 90 0.42 4 91 4.7 47 108 3.4 34 109 22.1 221 110 0.52 5 111 7.4 74 144 3 30 145 29 290 146 0.36 4 147 17.1 171 149 2.8 28 180 99.99 999 181 0.63 6 182 96.3 963 183 6.1 61 184 30.2 302 185 0.21 2 186 3 30 //