MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP010112

1,2-BISPHENYLTHIOMETHANE; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010112
RECORD_TITLE: 1,2-BISPHENYLTHIOMETHANE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KURARAY CO., LTD.
LICENSE: CC BY-NC-SA

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CH$NAME: 1,2-BISPHENYLTHIOMETHANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₃H₁₂S₂
CH$EXACT_MASS: 232.03804
CH$SMILES: c(c2)ccc(c2)SCSc(c1)cccc1
CH$IUPAC: InChI=1S/C13H12S2/c1-3-7-12(8-4-1)14-11-15-13-9-5-2-6-10-13/h1-10H,11H2
CH$LINK: INCHIKEY ZHUPZVIALZHGGP-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID20189083

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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

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MS$FOCUSED_ION: ION_TYPE [M]+*

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PK$SPLASH: splash10-00di-3920000000-9e80d01f37e9cc406646
PK$NUM_PEAK: 16
PK$PEAK: m/z int. rel.int.
  45 21 210
  51 5.2 52
  65 3.1 31
  69 0.11 1
  77 8.3 83
  78 1.1 11
  79 4.2 42
  91 0.11 1
  109 4.2 42
  121 1.1 11
  123 99.99 999
  124 0.9 9
  125 4.2 42
  232 25 250
  233 4.2 42
  234 2.1 21
//