MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP002752
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002752
RECORD_TITLE: TRIMETHYLSILYL FUCOSTEROL; 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$NAME: TRIMETHYLSILYL FUCOSTEROL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C32H56OSi
CH$EXACT_MASS: 484.41004
CH$SMILES: C(C3([H])1)CC(C([H])(C(CCC(C(C)C)=CC)([H])C)4)(C([H])(CC4)C1(CC=C(C32C)CC(CC2)(O[Si](C)(C)C)[H])[H])C
CH$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/h10,13,22-23,26-30H,11-12,14-21H2,1-9H3/b24-10-/t23-,26+,27+,28-,29+,30+,31+,32-/m1/s1
CH$LINK: INCHIKEY
LPZCEKQSHGYQRN-AAFSFRDQSA-N
AC$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: splash10-054k-2953000000-92e0f8512b893ecce774
PK$NUM_PEAK: 246
PK$PEAK: m/z int. rel.int.
55 6.8 68
57 1 10
67 4.3 43
68 0.1 1
69 12 120
70 1 10
71 2 20
73 1.74 17
74 1.9 19
75 20.5 205
76 1.7 17
77 0.34 3
79 6.5 65
80 1.1 11
81 16.5 165
82 0.22 2
83 11 110
84 1.3 13
85 2.1 21
89 0.11 1
91 11.9 119
92 2.9 29
93 15 150
94 0.36 4
95 24.4 244
96 2.6 26
97 23 230
98 0.24 2
99 1.1 11
101 1.9 19
103 2 20
104 0.15 2
105 20 200
106 6.2 62
107 26.6 266
108 0.57 6
109 21 210
110 3.6 36
111 11.4 114
112 0.13 1
113 1 10
115 3.6 36
116 2.2 22
117 8.1 81
118 0.47 5
119 30.8 308
120 16 160
121 30.7 307
122 0.55 6
123 13.7 137
124 1.7 17
125 3.8 38
127 0.12 1
128 2.8 28
129 99.99 999
130 16.1 161
131 2.09 21
132 7.4 74
133 23 230
134 7.1 71
135 1.79 18
136 3.7 37
137 10.8 108
138 2.9 29
139 0.49 5
140 1 10
141 3.5 35
142 3.4 34
143 1.95 20
144 7.4 74
145 33.8 338
146 10.4 104
147 2.53 25
148 7 70
149 13.1 131
150 2.3 23
151 0.37 4
152 1 10
153 1.4 14
154 1 10
155 0.75 8
156 4.5 45
157 12.2 122
158 12.5 125
159 3.16 32
160 15 150
161 29 290
162 5.6 56
163 1.22 12
164 2.2 22
165 4 40
166 1 10
167 0.14 1
168 1.7 17
169 6.9 69
170 2.4 24
171 0.86 9
172 6.9 69
173 16.3 163
174 6.8 68
175 1.56 16
176 4.1 41
177 6.2 62
178 1.4 14
179 0.2 2
181 3.2 32
182 2.2 22
183 4.3 43
184 0.19 2
185 9.7 97
186 4.5 45
187 10.4 104
188 0.44 4
189 12.8 128
190 2.7 27
191 3.4 34
192 0.11 1
193 1.7 17
194 1.2 12
195 3.4 34
196 0.4 4
197 7.6 76
198 3.3 33
199 11.1 111
200 0.48 5
201 10.6 106
202 3.8 38
203 10.1 101
204 0.21 2
205 2 20
207 1.4 14
208 1.1 11
209 0.2 2
210 1.1 11
211 16.4 164
212 6.1 61
213 2.57 26
214 10.9 109
215 12.4 124
216 3.4 34
217 0.87 9
218 1.8 18
219 2.4 24
220 1 10
221 0.18 2
223 1.3 13
225 4.1 41
226 2.8 28
227 1.15 12
228 12.2 122
229 8.7 87
230 2.2 22
231 0.45 5
232 1.2 12
233 2.7 27
234 1.2 12
235 0.15 2
239 5.4 54
240 3.4 34
241 6.4 64
242 0.34 3
243 11.9 119
244 3.2 32
245 4.4 44
246 0.15 2
247 1.9 19
248 1.5 15
249 1.2 12
251 0.13 1
252 1.3 13
253 20.9 209
254 8.2 82
255 2.16 22
256 11.4 114
257 41.6 416
258 8.6 86
259 0.33 3
266 1.1 11
267 4.7 47
268 3 30
269 0.21 2
270 2.5 25
271 4.1 41
272 2.1 21
273 1.39 14
274 3.6 36
281 41 410
282 11.8 118
283 0.76 8
284 2.1 21
285 2.6 26
286 1.3 13
287 0.13 1
294 1 10
295 3.3 33
296 89 890
297 2.48 25
301 5.9 59
302 2.3 23
303 2.6 26
304 0.25 3
305 1 10
317 1.1 11
318 2.8 28
327 0.26 3
330 1.5 15
337 1.2 12
339 1.3 13
340 0.12 1
342 1.6 16
343 8.9 89
344 4.3 43
345 0.18 2
351 2 20
352 3.1 31
353 4.9 49
354 0.82 8
355 43 430
356 11.6 116
357 2.7 27
365 0.16 2
366 2.4 24
371 13.4 134
372 6.1 61
373 0.21 2
379 25.7 257
380 8.7 87
381 1.5 15
386 8.12 81
387 27 270
388 8.2 82
389 1.9 19
392 0.28 3
393 2.7 27
394 31.2 312
395 9.8 98
396 0.19 2
469 13.2 132
470 5.6 56
471 1.7 17
482 0.11 1
483 1.2 12
484 8.7 87
485 3.7 37
486 0.11 1
487 0.4 4
//
