ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004108
RECORD_TITLE: 2,41-DICHLOROBENZOPHEWONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: 2,41-DICHLOROBENZOPHEWONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C13H8Cl2O
CH$EXACT_MASS: 249.99522
CH$SMILES: Clc(c2)ccc(c2)C(=O)c(c1)c(Cl)ccc1
CH$IUPAC: InChI=1S/C13H8Cl2O/c14-10-7-5-9(6-8-10)13(16)11-3-1-2-4-12(11)15/h1-8H
CH$LINK: INCHIKEY YXMYPHLWXBXNFF-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID6058920
AC$INSTRUMENT: HITACHI RMU-6E
AC$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$SPLASH: splash10-000i-2910000000-14666578b4963480f3b7
PK$NUM_PEAK: 25
PK$PEAK: m/z int. rel.int.
  50 6.5 65
  51 4.3 43
  74 4.1 41
  75 20.9 209
  76 5.8 58
  77 1.1 11
  85 2.3 23
  93 0.17 2
  110 1.1 11
  111 32.1 321
  112 3.4 34
  113 1.01 10
  139 99.99 999
  140 7.7 77
  141 31.6 316
  142 0.26 3
  150 1.8 18
  151 1.6 16
  152 2.9 29
  215 0.18 2
  250 19 190
  251 2.7 27
  252 12.3 123
  253 0.16 2
  254 2.1 21
//
