| SpectraBase Spectrum ID |
KqGtEI0udoJ |
| Name |
3-OXO-ANDROST-4-ENE-17-CARBOXYLIC ACID |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
316.203844759 u |
| Formula |
C20H28O3 |
| InChI |
InChI=1S/C20H28O3/c1-19-9-7-13(21)11-12(19)3-4-14-15-5-6-17(18(22)23)20(15,2)10-8-16(14)19/h11,14-17H,3-10H2,1-2H3,(H,22,23)/t14-,15-,16-,17?,19-,20-/m0/s1 |
| InChIKey |
YQACAXHKQZCEOI-SCZYCMLPSA-N |
| Molecular Weight |
316.441 g/mol |
| Nominal Mass |
316 u |
| Number of Peaks |
69 |
| SMILES |
OC(=O)C1CC[C@]2([C@@]3(CCC4=CC(CC[C@@]4([C@]3(CC[C@]12C)[H])C)=O)[H])[H] |
| SPLASH |
splash10-00dl-8932000000-8ae72210393435396350 |
| Source File Reference |
LMCM-59737-605E |
| Source of Spectrum |
Prof. Spiteller, University Bayreuth, Germany |
| Synonyms |
3-OXOANDROST-4-ENE-17-CARBOXYLIC ACID
(8S,9S,10R,13S,14S)-10,13-dimethyl-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-17-carboxylic acid |
| Wiley ID |
4_333 |
