ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009163
RECORD_TITLE: 2-(ETHYLTHIO)ETHANOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SODA AROMATIC CO., LTD.
LICENSE: CC BY-NC-SA
CH$NAME: 2-(ETHYLTHIO)ETHANOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C4H10OS
CH$EXACT_MASS: 106.04524
CH$SMILES: OCCSCC
CH$IUPAC: InChI=1S/C4H10OS/c1-2-6-4-3-5/h5H,2-4H2,1H3
CH$LINK: INCHIKEY LNRIEBFNWGMXKP-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID3059393
AC$INSTRUMENT: HITACHI M-80B
AC$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$SPLASH: splash10-004j-9100000000-cea282d37595be14a5c8
PK$NUM_PEAK: 31
PK$PEAK: m/z int. rel.int.
  14 1.06 11
  15 4 40
  19 1.46 15
  26 6.11 61
  27 31.65 317
  28 3.96 40
  29 26.17 262
  31 16.57 166
  35 6.3 63
  41 6.78 68
  42 2.31 23
  43 7.76 78
  44 6.51 65
  45 29.39 294
  46 14.77 148
  47 63.17 632
  48 8.31 83
  49 2.94 29
  57 2.11 21
  58 6.86 69
  59 14.68 147
  60 13.67 137
  61 21.15 212
  62 11.52 115
  63 13.33 133
  75 99.99 999
  76 6.35 64
  77 6.19 62
  106 48.31 483
  107 2.45 25
  108 1.91 19
//
