MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP002740
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002740
RECORD_TITLE: METHYL 2-TRIMETHYLSILOXY-DODECANOATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HAYASHI A, DEPT. OF CHEMISTRY, FAC. OF SCI. AND TECHNOLOGY, KINKI UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: METHYL 2-TRIMETHYLSILOXY-DODECANOATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C16H34O3Si
CH$EXACT_MASS: 302.22772
CH$SMILES: CCCCCCCCCCC(C(=O)OC)O[Si](C)(C)C
CH$IUPAC: InChI=1S/C16H34O3Si/c1-6-7-8-9-10-11-12-13-14-15(16(17)18-2)19-20(3,4)5/h15H,6-14H2,1-5H3
CH$LINK: INCHIKEY
PHPBKGTVQKCOSS-UHFFFAOYSA-N
AC$INSTRUMENT: SHIMADZU LKB-9000B
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: splash10-00ec-9120000000-7d8e020cbc9d2eac65bb
PK$NUM_PEAK: 108
PK$PEAK: m/z int. rel.int.
31 0.9 9
33 0.2 2
35 6 60
36 5 50
37 2.6 26
38 0.7 7
39 1.9 19
41 1.55 16
42 1 10
43 10.3 103
45 1.1 11
46 0.04 0
47 20.7 207
48 9.7 97
49 6.7 67
50 0.28 3
51 0.9 9
52 1 10
53 0.6 6
54 0.11 1
55 10.9 109
56 3.8 38
57 5.7 57
58 0.18 2
59 19.8 198
60 0.5 5
61 2.4 24
67 0.37 4
68 1.3 13
69 19.7 197
70 0.9 9
71 0.51 5
72 2.5 25
73 99.99 999
74 9.5 95
75 2.28 23
76 1.3 13
77 0.9 9
79 2.1 21
81 0.37 4
82 1.5 15
83 69.5 695
84 1 10
85 4.55 46
86 0.1 1
87 2.3 23
88 0.9 9
89 4.9 49
90 4.6 46
91 5.7 57
93 1.3 13
95 0.31 3
96 1.5 15
97 21.8 218
98 1.5 15
100 0.12 1
101 7.1 71
102 0.5 5
103 22.4 224
104 0.31 3
105 2.6 26
107 1.3 13
109 1.8 18
111 0.54 5
112 1.1 11
113 1.4 14
114 1.1 11
115 0.33 3
116 2.3 23
117 1.7 17
118 1.3 13
119 0.5 5
120 1.4 14
123 1 10
126 0.4 4
128 0.01 0
129 7.8 78
130 1.5 15
131 3.7 37
133 0.02 0
142 1.1 11
143 0.6 6
144 0.1 1
145 0.61 6
146 2.6 26
147 0.9 9
149 1 10
157 0.13 1
158 0.6 6
159 7.6 76
160 1.6 16
161 0.12 1
162 1.4 14
172 0.1 1
173 1.1 11
185 0.1 1
187 0.3 3
201 0.9 9
203 0.3 3
207 0.14 1
215 0.3 3
243 64.8 648
244 13.6 136
245 0.34 3
259 3.4 34
287 21.9 219
288 4.7 47
289 1.2 12
//
system version 2.2.8-SNAPSHOT