MassBank Record: JP003621



 1,2,3-TRICHLOROBENZENE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP003621
RECORD_TITLE: 1,2,3-TRICHLOROBENZENE; 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$NAME: 1,2,3-TRICHLOROBENZENE CH$COMPOUND_CLASS: N/A CH$FORMULA: C6H3Cl3 CH$EXACT_MASS: 179.93003 CH$SMILES: Clc(c1)c(Cl)c(Cl)cc1 CH$IUPAC: InChI=1S/C6H3Cl3/c7-4-2-1-3-5(8)6(4)9/h1-3H CH$LINK: INCHIKEY RELMFMZEBKVZJC-UHFFFAOYSA-N CH$LINK: COMPTOX DTXSID8026193
AC$INSTRUMENT: Unknown AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-001i-1900000000-744b718f7818aa4bd0be PK$NUM_PEAK: 30 PK$PEAK: m/z int. rel.int. 49 2.2 22 50 3 30 54 2.8 28 55 0.22 2 72 6.5 65 73 6.3 63 74 12.3 123 75 0.76 8 84 7.4 74 85 2.5 25 86 2.3 23 90 0.65 7 91 6.1 61 92 2.2 22 108 2 20 109 1.47 15 110 3.2 32 111 5 50 144 2.6 26 145 2.54 25 146 3.3 33 147 16.5 165 149 2.5 25 180 99.99 999 181 8 80 182 97.2 972 183 7.5 75 184 3.13 31 185 2 20 186 3 30 //

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