ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004524
RECORD_TITLE: 1,2,3,4,5,6-HEXA-O-TRIMETHELSILYL-MYO-INOSITOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SEYAMA Y, DEPT. OF PHYSIOL. CHEMISTRY AND NUTRITION, FAC. OF MEDICINE, UNIV. OF TOKYO
LICENSE: CC BY-NC-SA

CH$NAME: 1,2,3,4,5,6-HEXA-O-TRIMETHELSILYL-MYO-INOSITOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₂₄H₆₀O₆Si₆
CH$EXACT_MASS: 612.30055
CH$SMILES: C(C1([H])O[Si](C)(C)C)(C(C(C(C1([H])O[Si](C)(C)C)([H])O[Si](C)(C)C)([H])O[Si](C)(C)C)([H])O[Si](C)(C)C)([H])O[Si](C)(C)C
CH$IUPAC: InChI=1S/C24H60O6Si6/c1-31(2,3)25-19-20(26-32(4,5)6)22(28-34(10,11)12)24(30-36(16,17)18)23(29-35(13,14)15)21(19)27-33(7,8)9/h19-24H,1-18H3/t19-,20-,21-,22+,23-,24-
CH$LINK: INCHIKEY FRTKXRNTVMCAKI-HPEVMFQJSA-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 70 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-066r-4589000000-293e23791a0a68738ecc
PK$NUM_PEAK: 81
PK$PEAK: m/z int. rel.int.
  72 1.02 10
  73 90.73 907
  74 7.61 76
  75 8.85 89
  76 0.52 5
  81 0.55 6
  93 0.53 5
  101 0.73 7
  103 5.68 57
  104 0.58 6
  117 0.69 7
  129 7.36 74
  130 0.87 9
  131 2.23 22
  133 7.41 74
  134 1.05 11
  135 0.67 7
  143 1.8 18
  147 38.02 380
  148 6.08 61
  149 3.89 39
  157 0.71 7
  161 1.06 11
  175 0.59 6
  177 0.85 9
  189 2.15 22
  190 1.67 17
  191 47.02 470
  192 8.63 86
  193 4.21 42
  194 0.5 5
  203 1 10
  204 19.45 195
  205 4.7 47
  206 1.78 18
  207 1.71 17
  215 0.81 8
  217 99.99 999
  218 20.72 207
  219 9.16 92
  220 1.34 13
  221 6.28 63
  222 1.43 14
  223 0.81 8
  230 1.75 18
  231 1.09 11
  243 1.32 13
  265 23.38 234
  266 5.94 59
  267 3.04 30
  268 0.6 6
  271 0.51 5
  291 5.82 58
  292 1.86 19
  293 3.48 35
  294 0.87 9
  305 93.73 937
  306 27.72 277
  307 14.05 141
  308 2.85 29
  309 0.74 7
  318 51.21 512
  319 22.8 228
  320 9.64 96
  321 2.52 25
  322 0.55 6
  343 1.36 14
  367 5.28 53
  368 1.85 19
  369 1 10
  393 2.67 27
  394 0.97 10
  395 0.56 6
  419 0.7 7
  432 5.21 52
  433 4.28 43
  434 2.1 21
  435 0.81 8
  507 2.36 24
  508 1.16 12
  612 0.59 6
//