MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP011361
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP011361
RECORD_TITLE: 1,1-DIMETHYLSILACYCLOHEXANE; 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$NAME: 1,1-DIMETHYLSILACYCLOHEXANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C7H16Si
CH$EXACT_MASS: 128.10213
CH$SMILES: C(C1)CC[Si](C)(C)C1
CH$IUPAC: InChI=1S/C7H16Si/c1-8(2)6-4-3-5-7-8/h3-7H2,1-2H3
CH$LINK: INCHIKEY
VPVXTYYXTKCTPM-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID6063276
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$SPLASH: splash10-03dr-9500000000-5e60b40b26e28936df96
PK$NUM_PEAK: 44
PK$PEAK: m/z int. rel.int.
27 2.4 24
28 7 70
29 4.6 46
31 5.2 52
32 1.9 19
39 2.4 24
41 2.6 26
42 2.5 25
43 22.9 229
44 4.7 47
45 9.4 94
46 0.8 8
53 1.8 18
54 0.6 6
55 3.9 39
56 0.8 8
57 3.2 32
58 7 70
59 44.3 443
60 3.3 33
61 1.6 16
66 0.7 7
67 1.4 14
69 1.7 17
70 1 10
71 6 60
72 15.5 155
73 3 30
74 0.7 7
83 1.5 15
84 2.2 22
85 85.4 854
86 10 100
87 3.5 35
97 1.3 13
99 2.4 24
100 4.4 44
111 1.6 16
113 99.99 999
114 11.6 116
115 4.1 41
128 33.5 335
129 4.1 41
130 1 10
//
system version 2.2.6-SNAPSHOT