MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP011367
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP011367
RECORD_TITLE: SILACYCLOHEXANE (1-D); 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$NAME: SILACYCLOHEXANE (1-D)
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C5H12Si
CH$EXACT_MASS: 100.07083
CH$SMILES: [2H][SiH](C1)CCCC1
CH$IUPAC: InChI=1S/C5H12Si/c1-2-4-6-5-3-1/h1-6H2/i6D
CH$LINK: INCHIKEY
VMNDCBPWBMKDBI-RAMDWTOOSA-N
AC$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: splash10-00di-9100000000-30bcb41551babb86ec1f
PK$NUM_PEAK: 47
PK$PEAK: m/z int. rel.int.
26 0.8 8
27 4.9 49
28 5 50
29 4.7 47
30 2 20
31 4 40
32 4.2 42
39 5.8 58
40 1.3 13
41 6.3 63
42 3.8 38
43 17.7 177
44 23 230
45 22.7 227
46 7.2 72
47 1.3 13
53 3 30
54 1.1 11
55 4.8 48
56 3.5 35
57 4.2 42
58 9.8 98
59 9.1 91
60 8.8 88
61 1.3 13
66 1.6 16
67 2.2 22
68 1 10
69 2 20
70 7.2 72
71 14.2 142
72 33.4 334
73 99.99 999
74 12 120
75 4 40
83 2.4 24
84 1.1 11
85 1 10
86 2.6 26
96 0.7 7
97 3.9 39
98 7.8 78
99 5.3 53
100 7.5 75
101 43.7 437
102 6.3 63
103 2.1 21
//
system version 2.2.6-SNAPSHOT