| SpectraBase Compound ID | 9WDyWItYMUW |
|---|---|
| InChI | InChI=1S/C36H52O2/c1-25(2)10-9-11-26(3)31-17-18-32-30-16-15-28-24-29(38-34(37)19-14-27-12-7-6-8-13-27)20-22-35(28,4)33(30)21-23-36(31,32)5/h6-8,12-15,19,25-26,29-33H,9-11,16-18,20-24H2,1-5H3/b19-14+ |
| InChIKey | FESYLMLHRKCTFF-XMHGGMMESA-N |
| Mol Weight | 516.8 g/mol |
| Molecular Formula | C36H52O2 |
| Exact Mass | 516.396731 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6Wk60yuJZDT |
|---|---|
| Name | Cholest-5-en-3-yl (2E)-3-phenyl-2-propenoate |
| CAS Registry Number | 1990-11-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C36H52O2 |
| InChI | InChI=1S/C36H52O2/c1-25(2)10-9-11-26(3)31-17-18-32-30-16-15-28-24-29(38-34(37)19-14-27-12-7-6-8-13-27)20-22-35(28,4)33(30)21-23-36(31,32)5/h6-8,12-15,19,25-26,29-33H,9-11,16-18,20-24H2,1-5H3/b19-14+ |
| InChIKey | FESYLMLHRKCTFF-XMHGGMMESA-N |
| Molecular Weight | 516.810 g/mol |
| SMILES | CC(C)CCCC(C)C1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)\C=C\c1ccccc1 |
| SPLASH | splash10-053s-6911000000-a02769a3f9d068f57e03 |
| Source of Spectrum | W5-0-0-0 |
| Synonyms | 5-Cholesten-3.beta.-ol cinnamate Cholest-5-en-3-ol (3.beta.)-, 3-phenyl-2-propenoate Cholest-5-en-3-ol (3beta)-, 3-phenyl-2-propenoate Cholesteryl cinnamate (E)-3-phenyl-2-propenoic acid [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] ester [17-(1,5-dimethylhexyl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] (E)-3-phenylprop-2-enoate [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] (E)-3-phenylprop-2-enoate EINECS 217-869-9 |
| Wiley ID | 1401508 |