SpectraBase Spectrum ID |
N815CBzGa |
Name |
5.ALPHA.-ANDROSTAN-1-ONE |
CAS Registry Number |
1755-29-9 |
Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
274.229665585 u |
Formula |
C19H30O |
InChI |
InChI=1S/C19H30O/c1-18-11-4-6-15(18)14-9-8-13-5-3-7-17(20)19(13,2)16(14)10-12-18/h13-16H,3-12H2,1-2H3/t13-,14+,15+,16+,18+,19+/m1/s1 |
InChIKey |
PJRSESMLRXNKTQ-HKQXQEGQSA-N |
Molecular Weight |
274.448 g/mol |
Nominal Mass |
274 u |
Number of Peaks |
70 |
SMILES |
C1CC([C@@]2([C@]3(CC[C@@]4(CCC[C@]4([C@@]3(CC[C@]2(C1)[H])[H])[H])C)[H])C)=O |
SPLASH |
splash10-0a4i-0290000000-5911910bde4fbcae6037 |
Source File Reference |
LMCM-58766-721N |
Source of Spectrum |
Dr. Makin, London Hospital Medical College, UK |
Synonyms |
ANDROSTAN-1-ONE
(5R,8S,9S,10S,13S,14S)-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-1-one |
Wiley ID |
4_656 |