MassBank Record: JP002642



 2,5-DICHLOROBENZOIC ACID METHYL ESTER; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP002642
RECORD_TITLE: 2,5-DICHLOROBENZOIC ACID METHYL ESTER; 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$NAME: 2,5-DICHLOROBENZOIC ACID METHYL ESTER CH$COMPOUND_CLASS: N/A CH$FORMULA: C8H6Cl2O2 CH$EXACT_MASS: 203.97448 CH$SMILES: COC(=O)c(c1)c(Cl)ccc(Cl)1 CH$IUPAC: InChI=1S/C8H6Cl2O2/c1-12-8(11)6-4-5(9)2-3-7(6)10/h2-4H,1H3
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$SPLASH: splash10-00b9-2920000000-bb334199ec4a0421b68e PK$NUM_PEAK: 22 PK$PEAK: m/z int. rel.int. 50 11 110 73 7.1 71 74 30.9 309 75 2.81 28 84 6.7 67 85 2.4 24 109 30.2 302 110 0.99 10 111 9.2 92 145 46.6 466 146 2.4 24 147 3.06 31 149 2.8 28 173 36.6 366 174 11.7 117 175 99.99 999 176 14.2 142 177 2.4 24 204 45.5 455 205 1.85 19 206 14.9 149 207 3.2 32 //