SpectraBase Spectrum ID |
8yKeb8RHdbC |
Name |
5.ALPHA.-ANDROST-2-ENE-17-ONE |
CAS Registry Number |
963-75-7 |
Copyright |
Copyright © 2011-2025 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
272.214015521 u |
Formula |
C19H28O |
InChI |
InChI=1S/C19H28O/c1-18-11-4-3-5-13(18)6-7-14-15-8-9-17(20)19(15,2)12-10-16(14)18/h3-4,13-16H,5-12H2,1-2H3/t13-,14+,15+,16+,18+,19+/m1/s1 |
InChIKey |
ISJVDMWNISUFRJ-HKQXQEGQSA-N |
Molecular Weight |
272.432 g/mol |
Nominal Mass |
272 u |
Number of Peaks |
116 |
SMILES |
C1=CC[C@@]2([C@]3(CC[C@@]4(C(CC[C@]4([C@@]3(CC[C@]2(C1)[H])[H])[H])=O)C)[H])C |
SPLASH |
splash10-00xr-6890000000-883940ddbac70e7ebefa |
Source File Reference |
LMCM-80740-299Y |
Source of Spectrum |
Dr. Makin, London Hospital Medical College, UK |
Synonyms |
ANDROST-2-EN-17-ONE
(5S,8R,9S,10S,13S,14S)-10,13-dimethyl-5,6,7,8,9,10,11,12,13,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17(4H)-one |
Wiley ID |
4_2473 |