| SpectraBase Compound ID | B5rS0WYOhUo |
|---|---|
| InChI | InChI=1S/C19H27ClO2/c1-18-10-8-15(21)17(20)14(18)4-3-11-12-5-6-16(22)19(12,2)9-7-13(11)18/h11-13,15,21H,3-10H2,1-2H3/t11-,12-,13-,15+,18+,19-/m0/s1 |
| InChIKey | DKEQYGBIBDJBTE-XGQFHDIMSA-N |
| Mol Weight | 322.88 g/mol |
| Molecular Formula | C19H27ClO2 |
| Exact Mass | 322.169958 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AVaxsxFjA7z |
|---|---|
| Name | (3alpha)-4-chloro-3-hydroxyandrost-4-en-17-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C19H27ClO2 |
| InChI | InChI=1S/C19H27ClO2/c1-18-10-8-15(21)17(20)14(18)4-3-11-12-5-6-16(22)19(12,2)9-7-13(11)18/h11-13,15,21H,3-10H2,1-2H3/t11-,12-,13-,15+,18+,19-/m0/s1 |
| InChIKey | DKEQYGBIBDJBTE-XGQFHDIMSA-N |
| Molecular Weight | 322.876 g/mol |
| SMILES | O[C@@]1(CC[C@]2(C(=C1Cl)CC[C@]1([C@@]3(CCC([C@]3(CC[C@]21[H])C)=O)[H])[H])C)[H] |
| SPLASH | splash10-00kr-1491000000-6522a5ce285e218d770c |
| Source of Spectrum | O-31-309-0 |
| Synonyms | (3R,8R,9S,10R,13S,14S)-4-chloranyl-10,13-dimethyl-3-oxidanyl-1,2,3,6,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-one (3R,8R,9S,10R,13S,14S)-4-chloro-3-hydroxy-10,13-dimethyl-1,2,3,6,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-one |
| Wiley ID | 1321821 |