ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005236
RECORD_TITLE: (2BETA,4BETA)-DIMETHYL-(3ALPHA)-(3-ETHYLENEDIOXYPROPYL)-(7BETA)-(1-METHYL-3-TERT-BUTYLDIMETHYLSILOXYPROPYL)CYCLOHEPTANONE; CI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HISAHIRO HAGIWARA, CHEMICAL RESEARCH INSTITUTE OF NON-AQUEOUSSOLUTIONS TOHOKU UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: (2BETA,4BETA)-DIMETHYL-(3ALPHA)-(3-ETHYLENEDIOXYPROPYL)-(7BETA)-(1-METHYL-3-TERT-BUTYLDIMETHYLSILOXYPROPYL)CYCLOHEPTANONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₂₄H₄₆O₄Si
CH$EXACT_MASS: 426.31654
CH$SMILES: N/A
CH$IUPAC: N/A

AC$INSTRUMENT: JEOL JMS-DX-300
AC$INSTRUMENT_TYPE: CI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV
AC$MASS_SPECTROMETRY: REAGENT_GAS METHANE

PK$SPLASH: splash10-0002-3190300000-947f85b589b663546278
PK$NUM_PEAK: 67
PK$PEAK: m/z int. rel.int.
  31 3.8 38
  43 3.3 33
  55 3.8 38
  56 0.16 2
  57 16.5 165
  59 5.6 56
  69 1.9 19
  73 0.61 6
  75 14.6 146
  77 1.5 15
  81 2.3 23
  85 0.14 1
  87 10.3 103
  89 1 10
  91 1.1 11
  93 0.21 2
  95 2.4 24
  105 1.6 16
  107 1.4 14
  109 0.13 1
  113 1.1 11
  115 5 50
  117 3.7 37
  121 1.33 13
  133 5.5 55
  135 1.3 13
  145 1.2 12
  149 0.16 2
  161 3.4 34
  163 1.8 18
  165 1.2 12
  173 0.12 1
  179 1.6 16
  189 1.2 12
  191 2.1 21
  201 0.36 4
  203 2.4 24
  217 2.9 29
  219 23.6 236
  220 0.43 4
  221 10 100
  222 1.5 15
  235 1.3 13
  237 0.51 5
  247 1.2 12
  254 1.2 12
  279 1.7 17
  293 1.23 12
  294 3.8 38
  295 99.99 999
  296 20 200
  297 0.24 2
  323 6.4 64
  324 1.5 15
  335 2.8 28
  369 1.61 16
  370 4.7 47
  411 21.1 211
  412 6.1 61
  413 0.18 2
  425 9.5 95
  426 3.2 32
  427 22.3 223
  428 0.71 7
  429 2 20
  455 2.9 29
  467 1.2 12
//