ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002145
RECORD_TITLE: DIBENZOTHIOPHENE; 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$NAME: DIBENZOTHIOPHENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₂H₈S
CH$EXACT_MASS: 184.03467
CH$SMILES: c(c3)cc(s1)c(c3)c(c2)c(ccc2)1
CH$IUPAC: InChI=1S/C12H8S/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11/h1-8H
CH$LINK: INCHIKEY IYYZUPMFVPLQIF-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID0047741

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$SPLASH: splash10-001i-1900000000-2b4678815c405c7d2ef4
PK$NUM_PEAK: 14
PK$PEAK: m/z int. rel.int.
  44 3.9 39
  63 3.2 32
  79 8.2 82
  91 0.45 5
  92 12.5 125
  138 3.5 35
  139 15.4 154
  140 0.39 4
  152 11.4 114
  182 3.5 35
  183 5.8 58
  184 99.99 999
  185 17.5 175
  186 8.3 83
//