| SpectraBase Spectrum ID |
521LDl9xLs |
| Name |
5.ALPHA.-ANDROSTAN-3-ONE |
| CAS Registry Number |
1224-95-9 |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
274.229665585 u |
| Formula |
C19H30O |
| InChI |
InChI=1S/C19H30O/c1-18-9-3-4-16(18)15-6-5-13-12-14(20)7-11-19(13,2)17(15)8-10-18/h13,15-17H,3-12H2,1-2H3/t13-,15-,16-,17-,18-,19-/m0/s1 |
| InChIKey |
VMNRNUNYBVFVQI-QYXZOKGRSA-N |
| Molecular Weight |
274.448 g/mol |
| Nominal Mass |
274 u |
| Number of Peaks |
88 |
| SMILES |
C1(CC[C@@]2([C@]3(CC[C@@]4(CCC[C@]4([C@@]3(CC[C@]2(C1)[H])[H])[H])C)[H])C)=O |
| SPLASH |
splash10-0uk9-7490000000-4c3ec1ff1631f9340282 |
| Source File Reference |
LMCM-30920-639G |
| Source of Spectrum |
Prof. Spiteller, University Bayreuth, Germany |
| Synonyms |
ANDROSTAN-3-ONE, (5.ALPHA.)-
ANDROSTAN-3-ONE
(5S,8S,9S,10S,13S,14S)-10,13-dimethyltetradecahydro-1H-cyclopenta[a]phenanthren-3(2H)-one |
| Wiley ID |
4_577 |
