ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP011598
RECORD_TITLE: SILACYCLOHEXANE (2,2,6,6-D4); EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: SILACYCLOHEXANE (2,2,6,6-D4)
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₅H₁₂Si
CH$EXACT_MASS: 100.07083
CH$SMILES: [2H]C([2H])(C1)[SiH2]C([2H])([2H])CC1
CH$IUPAC: InChI=1S/C5H12Si/c1-2-4-6-5-3-1/h1-6H2/i4D2,5D2
CH$LINK: INCHIKEY VMNDCBPWBMKDBI-CQOLUAMGSA-N

AC$INSTRUMENT: HITACHI RMU-6M
AC$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$SPLASH: splash10-0fk9-9200000000-7079a1b25f4913509e04
PK$NUM_PEAK: 52
PK$PEAK: m/z int. rel.int.
  27 2.9 29
  28 7.6 76
  29 6.2 62
  30 5.1 51
  31 3.8 38
  32 5.2 52
  33 1.7 17
  39 2.5 25
  40 4.8 48
  41 3.7 37
  42 3.5 35
  43 12.1 121
  44 28.5 285
  45 25.9 259
  46 21.2 212
  47 9.3 93
  48 2.8 28
  53 2.8 28
  54 2.8 28
  55 3.4 34
  56 5.3 53
  57 6.5 65
  58 4.8 48
  59 7.5 75
  60 13.1 131
  61 10.3 103
  62 4 40
  63 1.9 19
  66 1.2 12
  67 1.9 19
  68 1.2 12
  69 2.6 26
  70 2.1 21
  71 4.1 41
  72 11.5 115
  73 25.1 251
  74 99.99 999
  75 23 230
  76 25 250
  77 3.2 32
  78 1.3 13
  85 2.3 23
  86 1.5 15
  87 3 30
  88 1 10
  89 2 20
  101 6.2 62
  102 9.2 92
  103 15.6 156
  104 54 540
  105 6.6 66
  106 2.1 21
//