ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004879
RECORD_TITLE: METHYL 9,10-BIS(TRIMETHYLSILOXY)OCTADEC-12(Z)-ENOATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KATO T, DEPT. OF CHEM., FAC. OF SCI., TOHOKU UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: METHYL 9,10-BIS(TRIMETHYLSILOXY)OCTADEC-12(Z)-ENOATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₂₅H₅₂O₄Si₂
CH$EXACT_MASS: 472.34041
CH$SMILES: CCCCCC=CCC(O[Si](C)(C)C)C(CCCCCCCC(=O)OC)O[Si](C)(C)C
CH$IUPAC: InChI=1S/C25H52O4Si2/c1-9-10-11-12-14-17-20-23(28-30(3,4)5)24(29-31(6,7)8)21-18-15-13-16-19-22-25(26)27-2/h14,17,23-24H,9-13,15-16,18-22H2,1-8H3/b17-14-
CH$LINK: INCHIKEY AXALTMLNQNROGB-VKAVYKQESA-N

AC$INSTRUMENT: Unknown
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 35 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-0c00-1491000000-e7bd5b5394847ab78160
PK$NUM_PEAK: 64
PK$PEAK: m/z int. rel.int.
  67 6.19 62
  69 3.97 40
  73 37.97 380
  75 7.75 78
  81 6.2 62
  93 2.66 27
  95 2.33 23
  101 2.27 23
  103 15.08 151
  104 1.87 19
  105 1.76 18
  107 3.12 31
  109 9.32 93
  110 1.79 18
  121 3.16 32
  123 3.54 35
  125 4.14 41
  129 16.51 165
  130 3.47 35
  131 1.79 18
  133 4.01 40
  137 2.96 30
  139 2.24 22
  143 4.3 43
  146 3.36 34
  147 19.37 194
  148 3.53 35
  149 4.42 44
  155 25.97 260
  156 2.92 29
  159 5.94 59
  167 3.44 34
  173 5.17 52
  177 2.17 22
  191 1.98 20
  211 2.19 22
  212 12.68 127
  213 56.14 561
  214 11.8 118
  215 3.23 32
  225 2.8 28
  227 2.19 22
  243 8.24 82
  257 3.51 35
  258 3.21 32
  259 99.99 999
  260 20.5 205
  261 7.24 72
  270 3.31 33
  271 55.45 555
  272 11.31 113
  273 3.82 38
  275 7.42 74
  293 2.66 27
  299 6.84 68
  332 6.54 65
  333 3.24 32
  361 42.89 429
  362 11.31 113
  363 4.88 49
  382 3.19 32
  441 3.48 35
  442 1.76 18
  457 2.58 26
//