MassBank Record: JP002641



 3,5-DICHLOROBENZOIC ACID METHYL ESTER; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP002641
RECORD_TITLE: 3,5-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$NAME: 3,5-DICHLOROBENZOIC ACID METHYL ESTER CH$COMPOUND_CLASS: N/A CH$FORMULA: C8H6Cl2O2 CH$EXACT_MASS: 203.97448 CH$SMILES: COC(=O)c(c1)cc(Cl)cc(Cl)1 CH$IUPAC: InChI=1S/C8H6Cl2O2/c1-12-8(11)5-2-6(9)4-7(10)3-5/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$SPLASH: splash10-00fr-1910000000-fd62a52d32761f57d5b7 PK$NUM_PEAK: 28 PK$PEAK: m/z int. rel.int. 42 2.7 27 44 6.1 61 50 5.2 52 73 0.34 3 74 13.2 132 75 15.2 152 84 3.1 31 85 0.25 3 109 15.7 157 110 5.9 59 111 5.9 59 145 3.16 32 146 2.9 29 147 20 200 148 1.1 11 149 0.29 3 173 99.99 999 174 7.2 72 175 59.9 599 176 0.47 5 177 8.8 88 186 1.3 13 203 1.1 11 204 3.07 31 205 3.4 34 206 20 200 207 1.1 11 208 3.1 31 //