ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004901
RECORD_TITLE: 3-BROMOPROPYL PHENYL SULFIDE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA
CH$NAME: 3-BROMOPROPYL PHENYL SULFIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H11BrS
CH$EXACT_MASS: 229.97648
CH$SMILES: BrCCCSc(c1)cccc1
CH$IUPAC: InChI=1S/C9H11BrS/c10-7-4-8-11-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2
CH$LINK: CAS 3238-98-0
CH$LINK: INCHIKEY QKGLUZCZUKTKCC-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID40427656
AC$INSTRUMENT: JEOL JMS-D-3000
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: splash10-0089-1950000000-5c4e60e857b7e89387be
PK$NUM_PEAK: 28
PK$PEAK: m/z int. rel.int.
  41 8.37 84
  45 14.69 147
  65 1.12 11
  66 2.69 27
  73 2.89 29
  77 2.24 22
  79 2 20
  91 2.03 20
  109 10.11 101
  110 43.55 436
  111 4.31 43
  112 2.18 22
  117 1.41 14
  121 1.12 11
  123 99.99 999
  124 9.4 94
  125 4.94 49
  137 1.71 17
  149 1.23 12
  151 9.55 96
  168 2.21 22
  188 1.24 12
  190 1.14 11
  230 55.8 558
  231 6.37 64
  232 56.51 565
  233 6.46 65
  234 2.79 28
//
