MassBank Record: JP002696



 LANOSTA-8,24-DIEN-3-OL; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP002696
RECORD_TITLE: LANOSTA-8,24-DIEN-3-OL; 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$NAME: LANOSTA-8,24-DIEN-3-OL CH$NAME: LANOSTEROL CH$COMPOUND_CLASS: N/A CH$FORMULA: C30H50O CH$EXACT_MASS: 426.38617 CH$SMILES: C(C4(C)1)CC(O)C(C)(C)C(CCC(=C34)C(C(CC3)(C)2)(C)CCC2([H])C([H])(C)CCC=C(C)C)1[H] CH$IUPAC: InChI=1S/C30H50O/c1-20(2)10-9-11-21(3)22-14-18-30(8)24-12-13-25-27(4,5)26(31)16-17-28(25,6)23(24)15-19-29(22,30)7/h10,21-22,25-26,31H,9,11-19H2,1-8H3/t21-,22-,25+,26+,28-,29-,30+/m1/s1
AC$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: splash10-03dl-2953300000-ae1832f19369485ff53c PK$NUM_PEAK: 271 PK$PEAK: m/z int. rel.int. 41 1.7 17 53 1.5 15 55 11.1 111 56 1.4 14 57 2.9 29 65 2 20 67 7.6 76 68 0.21 2 69 49.3 493 70 3.4 34 71 4 40 77 0.34 3 78 1.1 11 79 10.8 108 81 24.3 243 82 0.43 4 83 13.7 137 84 1.7 17 85 2.2 22 91 1.31 13 92 2.5 25 93 18.5 185 94 3 30 95 3.97 40 96 5 50 97 9.7 97 98 1.4 14 103 0.19 2 104 2.1 21 105 24.9 249 106 4.2 42 107 3.02 30 108 6.2 62 109 60.8 608 110 6.4 64 111 0.9 9 112 1.6 16 115 4.9 49 116 2.3 23 117 0.73 7 118 2.7 27 119 30.5 305 120 8 80 121 3.38 34 122 9.3 93 123 26.2 262 124 3.8 38 125 0.35 4 127 3 30 128 4.8 48 129 6.9 69 130 0.4 4 131 15.1 151 132 5.5 55 133 25.4 254 134 0.82 8 135 33.7 337 136 7.6 76 137 16.7 167 138 0.27 3 139 2.8 28 141 4.4 44 142 4.3 43 143 0.93 9 144 4.1 41 145 23.3 233 146 6.4 64 147 2.68 27 148 7.4 74 149 22 220 150 2.7 27 151 0.52 5 152 3.2 32 153 4 40 154 3 30 155 0.6 6 156 4.6 46 157 12.3 123 158 5.5 55 159 2.5 25 160 8.2 82 161 29 290 162 6.4 64 163 1.29 13 164 2.9 29 165 8.1 81 166 2.6 26 167 0.3 3 168 2.6 26 169 7.5 75 170 3.5 35 171 1.41 14 172 5.1 51 173 22.5 225 174 6.2 62 175 1.99 20 176 3.8 38 177 8.3 83 178 2.4 24 179 0.52 5 180 2.8 28 181 2.8 28 182 2.4 24 183 0.7 7 184 3.5 35 185 11.9 119 186 6.1 61 187 2.8 28 188 6.8 68 189 32.8 328 190 7.1 71 191 1.06 11 192 3.2 32 193 3.7 37 194 1.5 15 195 0.36 4 196 2.6 26 197 7.3 73 198 4.2 42 199 1.08 11 200 4.8 48 201 17.6 176 202 7.3 73 203 22.1 221 204 8.1 81 205 13.9 139 206 4.6 46 207 0.27 3 208 1.9 19 209 4.1 41 210 2.9 29 211 0.51 5 212 4.3 43 213 14.1 141 214 6.8 68 215 2.12 21 216 5.2 52 217 7.5 75 218 2 20 219 0.49 5 220 2.3 23 221 2.3 23 223 3 30 224 0.29 3 225 6.6 66 226 3.5 35 227 15.8 158 228 0.63 6 229 19.6 196 230 4.1 41 231 6 60 232 0.19 2 233 3.7 37 237 2.6 26 238 2.1 21 239 0.71 7 240 5.3 53 241 21.2 212 242 6.3 63 243 1.17 12 244 3.7 37 245 8.2 82 246 3.3 33 247 0.78 8 248 1.7 17 249 1.7 17 251 2.7 27 252 0.15 2 253 6.9 69 254 3.9 39 255 15.3 153 256 0.46 5 257 13.5 135 258 5.7 57 259 16.9 169 260 0.45 5 261 3.1 31 265 1.9 19 266 1.6 16 267 0.45 5 268 2.4 24 269 7.4 74 270 3.7 37 271 1.45 15 272 6.6 66 273 10.8 108 274 3.5 35 275 0.19 2 279 2.7 27 280 2.1 21 281 4 40 282 0.35 4 283 7.5 75 284 2.9 29 285 4.5 45 286 0.24 2 287 2.2 22 288 2 20 293 3.1 31 294 0.14 1 295 6.2 62 296 3 30 297 10.8 108 298 0.34 3 299 5.5 55 300 2.7 27 307 2.1 21 308 0.17 2 309 6 60 310 2.5 25 311 9.3 93 312 0.37 4 313 3.4 34 314 3.1 31 315 6.3 63 316 0.25 3 317 1.2 12 323 6.4 64 324 3.4 34 325 0.7 7 326 3.7 37 327 4.8 48 328 2 20 329 0.2 2 337 4.9 49 338 2.6 26 339 11.2 112 340 0.44 4 341 7.4 74 342 2.8 28 344 1.9 19 350 0.15 2 351 2 20 352 1.8 18 353 2.1 21 355 0.23 2 363 4.9 49 365 6.5 65 366 2.5 25 373 0.27 3 375 2.5 25 376 6.9 69 377 5.3 53 378 3.5 35 379 2.2 22 389 2.3 23 390 1.7 17 391 0.96 10 392 6.4 64 393 86.5 865 394 27.7 277 395 0.53 5 396 3.8 38 397 3.7 37 398 2.5 25 399 0.15 2 404 2.3 23 405 2.1 21 406 5.2 52 407 0.39 4 408 13.7 137 409 15.5 155 410 6.3 63 411 99.99 999 412 32.9 329 413 5.6 56 424 9.1 91 425 0.43 4 426 25.7 257 427 9.4 94 428 2.5 25 //