MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP006232
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006232
RECORD_TITLE: STIGMASTERYL TRIMETHYLSILYL ETHER; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HASHIMOTO K, KYOTO COLLEGE OF PHARMACY
LICENSE: CC BY-NC-SA
CH$NAME: STIGMASTERYL TRIMETHYLSILYL ETHER
CH$NAME: STIGMASTA-5,22-DIEN-BETA-3-YL TRIMETHYLSILYL ETHER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C32H56OSi
CH$EXACT_MASS: 484.41004
CH$SMILES: C(C32[H])(C(C4)([H])C(C([H])(C4)C([H])(C)C=CC(CC)([H])C(C)C)(C)CC3)(CC=C(C21C)CC(CC1)(O[Si](C)(C)C)[H])[H]
CH$IUPAC: InChI=1S/C32H56OSi/c1-10-24(22(2)3)12-11-23(4)28-15-16-29-27-14-13-25-21-26(33-34(7,8)9)17-19-31(25,5)30(27)18-20-32(28,29)6/h11-13,22-24,26-30H,10,14-21H2,1-9H3/b12-11+/t23-,24-,26+,27+,28-,29+,30+,31+,32-/m1/s1
CH$LINK: INCHIKEY
SZLWSWKRZSAHBC-MZXORBNVSA-N
AC$INSTRUMENT: HITACHI M-80
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-001i-8933100000-eb20e59bf2f1f8723467
PK$NUM_PEAK: 127
PK$PEAK: m/z int. rel.int.
43 1.95 20
55 10.3 103
57 20.52 205
58 1.05 11
67 3.01 30
68 1.52 15
69 31.6 316
71 10.45 105
73 4.34 43
75 5.77 58
81 17.78 178
82 2.45 25
83 99.99 999
84 8.24 82
85 2.56 26
89 1.01 10
91 1.03 10
93 5.58 56
95 8.45 85
96 2.42 24
97 17.97 180
98 1.57 16
105 4.3 43
106 1.74 17
107 8.71 87
109 7.34 73
110 1.75 18
111 2.69 27
117 1.28 13
119 8.57 86
120 3.78 38
121 8.11 81
122 2.28 23
123 5.14 51
125 1.29 13
129 53.4 534
130 8.03 80
131 5.98 60
133 14.84 148
134 2.96 30
135 5.61 56
137 2.74 27
138 1.32 13
139 23.46 235
140 3.45 35
143 5.98 60
145 11.42 114
146 2.58 26
147 11.22 112
148 2.19 22
149 3.13 31
151 1.17 12
155 3.24 32
157 3.24 32
158 3.11 31
159 13.83 138
160 2.69 27
161 6.87 69
162 1.85 19
163 1.87 19
166 1.16 12
169 2.22 22
171 1.7 17
173 3.69 37
175 1.28 13
182 1.56 16
185 2.57 26
187 2.05 21
189 2.81 28
191 1.03 10
196 1.09 11
197 1.5 15
198 1.04 10
199 2.89 29
201 1.92 19
203 1.4 14
207 1.53 15
211 1.62 16
213 8.68 87
214 1.85 19
215 5.99 60
216 1.27 13
217 2.43 24
227 2.27 23
228 2.44 24
229 2.15 22
239 1.74 17
240 1.42 14
241 2.3 23
242 1.18 12
243 3.03 30
245 1.06 11
253 5.69 57
254 1.81 18
255 28.55 286
256 7.05 71
257 3.04 30
258 1.18 12
267 2.24 22
271 3.83 38
281 1.79 18
282 2.86 29
283 3.2 32
300 1.09 11
309 2.08 21
318 1.4 14
343 4.81 48
344 2.23 22
353 4.69 47
355 7.42 74
356 12.84 128
357 3.31 33
358 1.33 13
366 1.38 14
367 1.29 13
372 4.53 45
374 1.68 17
380 8.77 88
381 2.25 23
395 26.73 267
396 7.86 79
397 1.67 17
470 3.52 35
471 2.29 23
485 24.52 245
486 9.32 93
487 2.86 29
//