ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007966
RECORD_TITLE: BENZYL 2-HYDROXYPHENYL 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$NAME: BENZYL 2-HYDROXYPHENYL SULFIDE
CH$NAME: 2-PHENYLMETHYLTHIO-PHENOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₃H₁₂OS
CH$EXACT_MASS: 216.06089
CH$SMILES: Oc(c2)c(ccc2)SCc(c1)cccc1
CH$IUPAC: InChI=1S/C13H12OS/c14-12-8-4-5-9-13(12)15-10-11-6-2-1-3-7-11/h1-9,14H,10H2
CH$LINK: INCHIKEY OWZPCVGKLYOVLV-UHFFFAOYSA-N

AC$INSTRUMENT: HITACHI M-80
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-0006-9010000000-94d37d7760c0efcb3dc1
PK$NUM_PEAK: 14
PK$PEAK: m/z int. rel.int.
  39 5.1 51
  45 2.5 25
  51 2.5 25
  53 0.21 2
  63 3.2 32
  65 11.8 118
  77 0.9 9
  89 0.19 2
  91 99.99 999
  92 9.1 91
  125 1.1 11
  126 0.1 1
  216 21 210
  217 3.5 35
//