| SpectraBase Spectrum ID |
C3XJk6fNLgL |
| Name |
3.ALPHA.-ETHYNYL-17.BETA.-HYDROXY-3.BETA.-METHOXY-5.ALPHA.-ANDROSTANE |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
330.255880333 u |
| Formula |
C22H34O2 |
| InChI |
InChI=1S/C22H34O2/c1-5-22(24-4)13-12-20(2)15(14-22)6-7-16-17-8-9-19(23)21(17,3)11-10-18(16)20/h1,15-19,23H,6-14H2,2-4H3/t15-,16-,17-,18-,19-,20-,21-,22-/m0/s1 |
| InChIKey |
WWXKVJXUYAGEGE-JOFXYRRGSA-N |
| Molecular Weight |
330.512 g/mol |
| Nominal Mass |
330 u |
| Number of Peaks |
151 |
| SMILES |
O[C@]1(CC[C@]2([C@@]3(CC[C@]4(C[C@](CC[C@@]4([C@]3(CC[C@]12C)[H])C)(OC)C#C)[H])[H])[H])[H] |
| SPLASH |
splash10-001j-7942000000-f2fa11ed9bb8714b1827 |
| Source File Reference |
LMCM-22331-220K |
| Source of Spectrum |
Prof. Spiteller, University Bayreuth, Germany |
| Synonyms |
3-ETHYNYL-3-METHOXYANDROSTAN-17-OL
(3S,5S,8R,9S,10S,13S,14S,17S)-3-ethynyl-3-methoxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-ol |
| Wiley ID |
4_495 |
