ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004623
RECORD_TITLE: 3-ETHOXY-6-(5-METHYL-1-TRIMETHYLSILOXY-4-HEXENYL)-2-CYCLOHEXEN-1-ONE; 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$NAME: 3-ETHOXY-6-(5-METHYL-1-TRIMETHYLSILOXY-4-HEXENYL)-2-CYCLOHEXEN-1-ONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₈H₃₂O₃Si
CH$EXACT_MASS: 324.21207
CH$SMILES: CCOC(C1)=CC(=O)C(C1)C(CCC=C(C)C)O[Si](C)(C)C
CH$IUPAC: InChI=1S/C18H32O3Si/c1-7-20-15-11-12-16(17(19)13-15)18(21-22(4,5)6)10-8-9-14(2)3/h9,13,16,18H,7-8,10-12H2,1-6H3
CH$LINK: INCHIKEY GMLZOTBPHOVJRF-UHFFFAOYSA-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 25 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-00mo-9641000000-5f15462c599c10e8110b
PK$NUM_PEAK: 98
PK$PEAK: m/z int. rel.int.
  17 7.3 73
  18 90.4 904
  28 99.99 999
  29 0.1 1
  32 29.1 291
  40 2.3 23
  41 8.7 87
  43 1.08 11
  55 3.6 36
  56 4.1 41
  57 1.5 15
  58 0.27 3
  67 3.1 31
  68 3.7 37
  69 41.3 413
  70 0.28 3
  73 8.1 81
  74 1.3 13
  75 23.4 234
  76 0.11 1
  79 2.9 29
  81 2.5 25
  82 2.1 21
  83 0.27 3
  84 8.6 86
  93 2.7 27
  94 5.9 59
  95 1.78 18
  96 4.7 47
  97 1.4 14
  99 1 10
  101 0.13 1
  107 1 10
  109 1.9 19
  110 2 20
  111 0.69 7
  112 22.3 223
  113 1.2 12
  117 2.3 23
  123 0.29 3
  124 3.2 32
  125 1.9 19
  129 3.2 32
  137 0.3 3
  138 11.3 113
  139 6.8 68
  140 90.9 909
  141 0.75 8
  143 3.1 31
  151 4.2 42
  152 2.8 28
  153 0.57 6
  155 2 20
  156 1 10
  164 1 10
  165 0.29 3
  166 42.2 422
  167 6.9 69
  168 2.2 22
  169 1.42 14
  170 3.1 31
  171 1.3 13
  177 3 30
  178 0.16 2
  179 7.2 72
  183 3.2 32
  184 6.2 62
  185 0.83 8
  191 7.5 75
  192 1.6 16
  195 2.9 29
  197 1.22 12
  198 1.7 17
  205 1.4 14
  211 6.4 64
  212 1.1 11
  213 6.3 63
  214 1.5 15
  219 4.2 42
  225 0.11 1
  227 2.9 29
  228 1.1 11
  234 32.1 321
  235 0.58 6
  239 5.4 54
  240 2 20
  241 90.1 901
  242 2.08 21
  243 5 50
  252 1.2 12
  255 19.5 195
  256 0.41 4
  281 2.3 23
  309 18 180
  310 4.6 46
  311 0.1 1
  324 17.8 178
  325 4.5 45
//