MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP002733
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002733
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 23 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-000x-9150000000-37870e6038c6227eda66
PK$NUM_PEAK: 67
PK$PEAK: m/z int. rel.int.
30 0.4 4
32 0.5 5
36 5.1 51
38 2.5 25
40 0.2 2
42 0.2 2
46 0.1 1
47 0.54 5
48 4.5 45
49 2.6 26
50 1.6 16
55 0.29 3
56 0.9 9
57 3.5 35
59 0.2 2
60 0.19 2
69 13 130
70 0.9 9
71 5 50
72 0.01 0
73 28.1 281
74 1.5 15
75 1.1 11
81 0.17 2
82 0.7 7
83 99.99 999
84 0.4 4
85 6.8 68
86 0.5 5
87 7.4 74
89 12.4 124
90 0.18 2
91 4.1 41
97 17.5 175
98 1.5 15
99 0.13 1
102 0.7 7
103 17.9 179
104 2.8 28
105 0.2 2
107 2.2 22
111 5.3 53
115 0.8 8
116 0.17 2
117 2.4 24
118 3 30
119 3.7 37
120 0.32 3
126 0.8 8
127 0.7 7
128 0.7 7
129 0.06 1
130 0.5 5
131 1.5 15
146 0.9 9
147 0.01 0
159 0.9 9
190 0.2 2
203 0.7 7
207 0.19 2
243 87 870
244 18.1 181
245 4.6 46
259 0.24 2
287 23.8 238
288 5.1 51
289 1.7 17
//
system version 2.2.8-SNAPSHOT