ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005551
RECORD_TITLE: 1,6-DIMETHYL-5-METHYLENE-3,4-BENZO-2-THIABICYCLO(4.1.0)HEPT-3-ENE; 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$NAME: 1,6-DIMETHYL-5-METHYLENE-3,4-BENZO-2-THIABICYCLO(4.1.0)HEPT-3-ENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C13H14S
CH$EXACT_MASS: 202.08162
CH$SMILES: c(c3)cc(c(c3)2)C(=C)C(C)(C1)C(C)(S2)1
CH$IUPAC: InChI=1S/C13H14S/c1-9-10-6-4-5-7-11(10)14-13(3)8-12(9,13)2/h4-7H,1,8H2,2-3H3
CH$LINK: INCHIKEY XSUQCGXKUHOAEX-UHFFFAOYSA-N
AC$INSTRUMENT: HITACHI RMU-6L
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: splash10-0f79-5910000000-02c19950a0d4692824f4
PK$NUM_PEAK: 87
PK$PEAK: m/z int. rel.int.
  27 13 130
  29 5 50
  39 28 280
  41 18 180
  43 6 60
  45 17 170
  47 9 90
  50 7 70
  51 18 180
  52 5 50
  53 8 80
  55 5 50
  56 6 60
  57 7 70
  58 5 50
  59 18 180
  61 4 40
  62 6 60
  63 14 140
  64 4 40
  65 9 90
  69 10 100
  74 6 60
  75 8 80
  76 6 60
  77 14 140
  78 5 50
  79 4 40
  82 15 150
  84 6 60
  85 5 50
  86 6 60
  87 6 60
  89 8 80
  90 5 50
  91 22 220
  92 6 60
  101 4 40
  102 7 70
  103 6 60
  105 5 50
  106 6 60
  115 20 200
  116 5 50
  117 21 210
  119 18 180
  121 8 80
  127 8 80
  128 25 250
  129 10 100
  134 13 130
  135 5 50
  139 5 50
  141 15 150
  142 6 60
  143 10 100
  147 25 250
  148 7 70
  152 8 80
  153 10 100
  154 11 110
  155 10 100
  156 17 170
  157 5 50
  158 5 50
  159 5 50
  160 6 60
  161 33 330
  162 8 80
  169 21 210
  170 6 60
  171 17 170
  172 25 250
  173 8 80
  174 5 50
  175 8 80
  184 6 60
  185 8 80
  186 7 70
  187 99.99 999
  188 20 200
  189 7 70
  201 15 150
  202 72 720
  203 15 150
  204 7 70
  205 2 20
//
