ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010160
RECORD_TITLE: 4-CHLORO-3-PHENYLTHIOMETHOXYPHENOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KURARAY CO., LTD.
LICENSE: CC BY-NC-SA
CH$NAME: 4-CHLORO-3-PHENYLTHIOMETHOXYPHENOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C13H11ClO2S
CH$EXACT_MASS: 266.01683
CH$SMILES: Oc(c1)cc(OCSc(c2)cccc2)c(Cl)c1
CH$IUPAC: InChI=1S/C13H11ClO2S/c14-12-7-6-10(15)8-13(12)16-9-17-11-4-2-1-3-5-11/h1-8,15H,9H2
CH$LINK: INCHIKEY QKTJORZNGHGNDS-UHFFFAOYSA-N
AC$INSTRUMENT: JEOL JMS-D-300
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: splash10-00di-2900000000-54c22602eaa0bd797c35
PK$NUM_PEAK: 9
PK$PEAK: m/z int. rel.int.
  45 19 190
  51 4 40
  77 6 60
  79 0.3 3
  123 99.99 999
  124 8 80
  125 4 40
  231 0.6 6
  266 3 30
//
