ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000916
RECORD_TITLE: METHYL PENTYL DISULFIDE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KAMEOKA H, DEPT. OF APPLIED CHEMISTRY, FAC. OF SCI. AND ENGINEERING, KINKI UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: METHYL PENTYL DISULFIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₁₄S₂
CH$EXACT_MASS: 150.05369
CH$SMILES: CCCCCSSC
CH$IUPAC: InChI=1S/C6H14S2/c1-3-4-5-6-8-7-2/h3-6H2,1-2H3
CH$LINK: INCHIKEY VDJXDNLYBDHPHP-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID50222735

AC$INSTRUMENT: SHIMADZU LKB-9000B
AC$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$SPLASH: splash10-007o-9400000000-793ea6fa0781fadaeedb
PK$NUM_PEAK: 12
PK$PEAK: m/z int. rel.int.
  41 9.5 95
  43 99.99 999
  47 20 200
  61 1.27 13
  79 16.4 164
  80 70.9 709
  94 21.8 218
  108 1.82 18
  122 61.8 618
  150 41.8 418
  151 5.5 55
  152 3.6 36
//