MassBank Record: JP001863



 3BETA-TRIMETHYLSILOXY-5ALPHA,6ALPHA-EPOXYCHOLESTANE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP001863
RECORD_TITLE: 3BETA-TRIMETHYLSILOXY-5ALPHA,6ALPHA-EPOXYCHOLESTANE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SEYAMA Y, DEPT. OF PHYSIOL. CHEMISTRY AND NUTRITION, FAC. OF MEDICINE, UNIV. OF TOKYO
LICENSE: CC BY-NC-SA

CH$NAME: 3BETA-TRIMETHYLSILOXY-5ALPHA,6ALPHA-EPOXYCHOLESTANE CH$NAME: TRIMETHYLSILYL ALPHA-EPOXYCHOLESTEROL CH$COMPOUND_CLASS: N/A CH$FORMULA: C30H54O2Si CH$EXACT_MASS: 474.38931 CH$SMILES: [H]C(C3)(C4([H])5)C([H])(CCC(C)(C(C(CCCC(C)C)C)CC5)4)C(C)(C(C23)(O2)1)CCC(C1)O[Si](C)(C)C CH$IUPAC: InChI=1S/C30H54O2Si/c1-20(2)10-9-11-21(3)24-12-13-25-23-18-27-30(31-27)19-22(32-33(6,7)8)14-17-29(30,5)26(23)15-16-28(24,25)4/h20-27H,9-19H2,1-8H3/t21-,22+,23+,24-,25+,26+,27+,28-,29-,30+/m1/s1
AC$INSTRUMENT: SHIMADZU QP-1000 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: splash10-0avj-9710000000-05b0457dce95aa8c567c PK$NUM_PEAK: 210 PK$PEAK: m/z int. rel.int. 53 7 70 54 2.5 25 55 86.3 863 56 12.6 126 57 81.6 816 58 4.1 41 59 8.7 87 60 1.1 11 61 5.6 56 65 3.2 32 66 1.9 19 67 41.7 417 68 8.7 87 69 47.4 474 70 6.9 69 71 33 330 72 3.4 34 73 99.99 999 74 9.2 92 75 58.8 588 76 4.6 46 77 15.2 152 78 2.9 29 79 34.9 349 80 6.5 65 81 54.8 548 82 8 80 83 23.2 232 84 3.1 31 85 6.5 65 87 1 10 89 2.6 26 91 30.8 308 92 8.4 84 93 54.2 542 94 20.1 201 95 61.7 617 96 40 400 97 14.4 144 98 1.5 15 99 2.8 28 101 11.2 112 102 1.2 12 103 5.2 52 104 1.7 17 105 23.6 236 106 7.9 79 107 32.4 324 108 15.6 156 109 26.4 264 110 13.3 133 111 7.8 78 112 1.2 12 113 2 20 115 4.5 45 116 3.8 38 117 11.8 118 118 7.3 73 119 20.3 203 120 16 160 121 24.7 247 122 14.1 141 123 30 300 124 4.2 42 125 3.2 32 127 3.8 38 128 1.8 18 129 18.3 183 130 5.5 55 131 16.7 167 132 5.5 55 133 21.9 219 134 14.1 141 135 31.1 311 136 12.9 129 137 7.8 78 138 1.9 19 139 1.6 16 141 2.8 28 142 6 60 143 20.8 208 144 6.4 64 145 15.1 151 146 4.8 48 147 14 140 148 5.4 54 149 12.6 126 150 3.7 37 151 3.9 39 152 1 10 153 1.4 14 154 1 10 155 9.9 99 156 4.9 49 157 11 110 158 7.4 74 159 17.2 172 160 4.9 49 161 12.7 127 162 4.1 41 163 12.5 125 164 3.9 39 165 3.3 33 167 1.7 17 168 2.4 24 169 8.6 86 170 3.1 31 171 6.5 65 172 2.8 28 173 8.2 82 174 2.8 28 175 7.6 76 176 3.3 33 177 5.2 52 178 1.4 14 179 2.7 27 180 1.1 11 181 11.2 112 182 6.3 63 183 9 90 184 2.7 27 185 6.3 63 186 4.7 47 187 5.6 56 188 1.7 17 189 3.5 35 190 1.2 12 191 3.1 31 192 1 10 193 4 40 194 1.2 12 195 2.4 24 196 1.2 12 197 18.1 181 198 4.9 49 199 6.1 61 200 3.9 39 201 8.4 84 202 1.9 19 203 3.7 37 205 1.7 17 206 3 30 207 8.8 88 208 2.8 28 209 2.3 23 210 1 10 211 11 110 212 3.1 31 213 4.4 44 214 1.3 13 215 2.8 28 216 2 20 217 2.8 28 219 3.2 32 221 1.6 16 225 2.1 21 226 2.2 22 227 3.9 39 228 1.1 11 229 3.1 31 230 1.1 11 231 1.5 15 233 1.9 19 239 1.5 15 243 3.2 32 244 1.1 11 245 2.3 23 246 1.8 18 247 5.6 56 248 2 20 249 2.5 25 251 1.1 11 253 4.9 49 254 1.3 13 255 1.1 11 259 1.5 15 260 1.7 17 261 1.6 16 262 1.5 15 271 3.5 35 272 1 10 273 2.3 23 274 2 20 275 3.1 31 276 1.1 11 281 1.6 16 288 2 20 289 1.6 16 291 2.3 23 299 1 10 325 1.2 12 329 1.1 11 340 1.2 12 341 2.8 28 342 1.2 12 343 1.3 13 351 2.5 25 356 4.8 48 357 1.6 16 366 3.8 38 367 2.5 25 369 2.9 29 370 1 10 384 6.6 66 385 2.1 21 445 1.1 11 456 1 10 459 1.3 13 474 6.6 66 475 2.5 25 //