ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010011
RECORD_TITLE: SULFOLANE; 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$NAME: SULFOLANE
CH$NAME: TETRAHYDROTHIOPHENE 1,1-DIOXIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₄H₈O₂S
CH$EXACT_MASS: 120.02450
CH$SMILES: O=S(=O)(C1)CCC1
CH$IUPAC: InChI=1S/C4H8O2S/c5-7(6)3-1-2-4-7/h1-4H2
CH$LINK: INCHIKEY HXJUTPCZVOIRIF-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID3027037

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$SPLASH: splash10-05bf-9100000000-da096f8b6dee71e3b48a
PK$NUM_PEAK: 17
PK$PEAK: m/z int. rel.int.
  26 5.5 55
  27 18.1 181
  28 46.8 468
  29 1.25 13
  39 16.1 161
  40 4.7 47
  41 99.99 999
  42 0.42 4
  43 3.6 36
  48 3.5 35
  53 3.2 32
  55 8.67 87
  56 90.6 906
  57 5.4 54
  120 54.2 542
  121 0.31 3
  122 2.5 25
//