ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007515
RECORD_TITLE: 2,4-DICHLOROPHENYL ACETATE; 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$NAME: 2,4-DICHLOROPHENYL ACETATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C8H6Cl2O2
CH$EXACT_MASS: 203.97448
CH$SMILES: CC(=O)Oc(c1)c(Cl)cc(Cl)c1
CH$IUPAC: InChI=1S/C8H6Cl2O2/c1-5(11)12-8-3-2-6(9)4-7(8)10/h2-4H,1H3
CH$LINK: INCHIKEY KGXUYVOKSRCTEK-UHFFFAOYSA-N
AC$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: splash10-03dl-9700000000-d23926b5b2e03cd2b504
PK$NUM_PEAK: 39
PK$PEAK: m/z int. rel.int.
  37 3.8 38
  38 3.4 34
  39 2.7 27
  42 0.38 4
  43 99.99 999
  44 2.9 29
  49 2.2 22
  50 0.27 3
  53 2 20
  61 4.3 43
  62 8.6 86
  63 2.53 25
  64 2 20
  72 2.9 29
  73 13 130
  74 4.01 40
  75 5.7 57
  83 2.5 25
  85 1.5 15
  97 0.41 4
  98 10.5 105
  99 5.9 59
  100 3.1 31
  101 0.18 2
  107 2.5 25
  109 2.9 29
  126 4.1 41
  127 0.13 1
  128 6.8 68
  133 8.4 84
  135 5.9 59
  161 0.18 2
  162 67.1 671
  163 3.4 34
  164 34.7 347
  165 0.2 2
  166 5.4 54
  204 5 50
  206 3.8 38
//
