| SpectraBase Spectrum ID |
I1akmjVbSRW |
| Name |
ANDROSTA-1,4-DIENE-3,11,17-TRIONE |
| CAS Registry Number |
7738-93-4 |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
298.156894565 u |
| Formula |
C19H22O3 |
| InChI |
InChI=1S/C19H22O3/c1-18-8-7-12(20)9-11(18)3-4-13-14-5-6-16(22)19(14,2)10-15(21)17(13)18/h7-9,13-14,17H,3-6,10H2,1-2H3/t13-,14-,17+,18-,19-/m0/s1 |
| InChIKey |
RZACPWSZIQKVDY-IRIMSJTPSA-N |
| Molecular Weight |
298.382 g/mol |
| Nominal Mass |
298 u |
| Number of Peaks |
63 |
| SMILES |
C1(C=C[C@@]2([C@]3(C(C[C@@]4(C(CC[C@]4([C@@]3(CCC2=C1)[H])[H])=O)C)=O)[H])C)=O |
| SPLASH |
splash10-0005-5970000000-a1f01d1db03490176272 |
| Source File Reference |
LMCM-14401-744F |
| Source of Spectrum |
Dr. Makin, London Hospital Medical College, UK |
| Synonyms |
(8S,9S,10R,13S,14S)-10,13-dimethyl-7,8,10,12,13,14,15,16-octahydro-3H-cyclopenta[a]phenanthrene-3,11,17(6H,9H)-trione |
| Wiley ID |
4_1269 |
