| SpectraBase Compound ID | 39BmIJjXYTb |
|---|---|
| InChI | InChI=1S/C21H32O3/c1-13(22)24-15-5-8-19(2)14(11-15)12-16-17(19)6-9-20(3)18(16)7-10-21(20,4)23/h12,15-18,23H,5-11H2,1-4H3/t15-,16+,17-,18-,19-,20-,21-/m0/s1 |
| InChIKey | CAQUTDWCCKOELG-TVWVXWENSA-N |
| Mol Weight | 332.5 g/mol |
| Molecular Formula | C21H32O3 |
| Exact Mass | 332.235145 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 9QfvXizsA0o |
|---|---|
| Name | 17.ALPHA.-METHYL-6-NORANDROST-5-ENE-3.BETA.,17.BETA.-DIOL-(3.BETA.-ACETATE) |
| Copyright | Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass | 332.235144887 u |
| Formula | C21H32O3 |
| InChI | InChI=1S/C21H32O3/c1-13(22)24-15-5-8-19(2)14(11-15)12-16-17(19)6-9-20(3)18(16)7-10-21(20,4)23/h12,15-18,23H,5-11H2,1-4H3/t15-,16+,17-,18-,19-,20-,21-/m0/s1 |
| InChIKey | CAQUTDWCCKOELG-TVWVXWENSA-N |
| Molecular Weight | 332.484 g/mol |
| Nominal Mass | 332 u |
| Number of Peaks | 146 |
| SMILES | O[C@]1(CC[C@]2([C@@]3(C=C4C[C@](CC[C@@]4([C@]3(CC[C@]12C)[H])C)(OC(C)=O)[H])[H])[H])C |
| SPLASH | splash10-0abj-2940000000-8de3a664052e82776429 |
| Source File Reference | LMCM-97726-227H |
| Source of Spectrum | Dr. Makin, London Hospital Medical College, UK |
| Synonyms | 3-HYDROXY-3,3A,5B-TRIMETHYL-1,2,3,3A,4,5,5A,5B,6,7,8,9,10A,10B-TETRADECAHYDROCYCLOPENTA[A]FLUOREN-8-YL ACETATE (3S,3aS,5aS,5bR,8S,10aR,10bS)-3-hydroxy-3,3a,5b-trimethyl-1,2,3,3a,4,5,5a,5b,6,7,8,9,10a,10b-tetradecahydrocyclopenta[a]fluoren-8-yl acetate |
| Wiley ID | 4_1627 |