ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP011758
RECORD_TITLE: (E)-1-(METHYLDIPHENYL)-4-METHYLBUT-1-EN-3-YNE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: FAC. TECHNOLOGY, HIROSHIMA UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: (E)-1-(METHYLDIPHENYL)-4-METHYLBUT-1-EN-3-YNE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₈H₁₈Si
CH$EXACT_MASS: 262.11778
CH$SMILES: CC#CC([H])=C([H])[Si](C)(c(c2)cccc2)c(c1)cccc1
CH$IUPAC: InChI=1S/C18H18Si/c1-3-4-11-16-19(2,17-12-7-5-8-13-17)18-14-9-6-10-15-18/h5-16H,1-2H3/b16-11+
CH$LINK: INCHIKEY IETJPYGXIFCQBT-LFIBNONCSA-N

AC$INSTRUMENT: SHIMADZU QP-1000
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-00dj-1950000000-e7d16c0059c4c43efcdf
PK$NUM_PEAK: 74
PK$PEAK: m/z int. rel.int.
  32 1.8 18
  36 1.5 15
  41 2.9 29
  42 6 60
  43 6.8 68
  45 2 20
  56 8.3 83
  57 11 110
  58 2.7 27
  59 6.3 63
  71 2.3 23
  78 2.6 26
  82 3 30
  83 1.2 12
  84 1.5 15
  86 1.6 16
  97 1.1 11
  105 9.3 93
  106 1.4 14
  119 1.2 12
  120 76.8 768
  121 99.99 999
  122 13.4 134
  123 3.5 35
  131 1.2 12
  133 3.1 31
  134 6.7 67
  135 1.1 11
  141 1.5 15
  142 3.6 36
  143 1.4 14
  144 1.9 19
  145 8.5 85
  146 4.4 44
  147 3.1 31
  158 3.3 33
  159 4.5 45
  160 1.9 19
  169 17.8 178
  170 3 30
  171 2.5 25
  178 1.3 13
  183 7.6 76
  184 46.6 466
  185 9.4 94
  186 2.5 25
  197 1.5 15
  202 3.9 39
  203 4.8 48
  204 2.7 27
  205 1.1 11
  207 18.2 182
  208 4.4 44
  209 1.3 13
  217 3.2 32
  218 1.4 14
  219 1.1 11
  220 1 10
  221 2.6 26
  222 6.9 69
  223 1.6 16
  233 1.4 14
  234 6.7 67
  235 1.5 15
  245 6.4 64
  246 2.3 23
  247 80.8 808
  248 16.4 164
  249 3.6 36
  260 1.4 14
  261 6.5 65
  262 15.5 155
  263 3.6 36
  264 1 10
//