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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP005727

METHYL DISULFIDE; EI-B; MS

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005727
RECORD_TITLE: METHYL DISULFIDE; 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$NAME: METHYL DISULFIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C2H6S2
CH$EXACT_MASS: 93.99109
CH$SMILES: CSSC
CH$IUPAC: InChI=1S/C2H6S2/c1-3-4-2/h1-2H3
CH$LINK: CAS 624-92-0
CH$LINK: INCHIKEY WQOXQRCZOLPYPM-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID4025117

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 70 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-0005-9000000000-41761824faab2335162b
PK$NUM_PEAK: 35
PK$PEAK: m/z int. rel.int.
  15 25.13 251
  16 0.4 4
  17 0.27 3
  18 1.1 11
  27 0.91 9
  28 6.46 65
  32 8.21 82
  33 2.33 23
  34 0.94 9
  35 0.8 8
  44 7.87 79
  45 99.99 999
  46 45.09 451
  47 32.55 326
  48 13.05 131
  49 4.05 41
  50 0.57 6
  61 16.48 165
  62 0.57 6
  63 0.68 7
  64 16.28 163
  65 0.8 8
  66 1.53 15
  76 0.92 9
  77 0.64 6
  78 3.18 32
  79 56.53 565
  80 2.27 23
  81 5.23 52
  93 0.97 10
  94 95.76 958
  95 4.41 44
  96 8.6 86
  97 0.31 3
  98 0.22 2
//

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