MassBank Record: JP002752



 TRIMETHYLSILYL FUCOSTEROL; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: 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
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 22 118 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 4 117 8.1 81 //