| SpectraBase Compound ID | 1Rg2OkXPxhg |
|---|---|
| InChI | InChI=1S/C21H30O3/c1-13(23)17-5-6-18-16-4-3-14-11-15(24)7-10-21(14,12-22)19(16)8-9-20(17,18)2/h11,16-19,22H,3-10,12H2,1-2H3 |
| InChIKey | FIHWBGCIKMXLBI-UHFFFAOYSA-N |
| Mol Weight | 330.47 g/mol |
| Molecular Formula | C21H30O3 |
| Exact Mass | 330.219495 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7J3G1CR8B2F |
|---|---|
| Name | Pregn-4-ene-3,20-dione, 19-hydroxy- |
| CAS Registry Number | 596-63-4 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H30O3 |
| InChI | InChI=1S/C21H30O3/c1-13(23)17-5-6-18-16-4-3-14-11-15(24)7-10-21(14,12-22)19(16)8-9-20(17,18)2/h11,16-19,22H,3-10,12H2,1-2H3 |
| InChIKey | FIHWBGCIKMXLBI-UHFFFAOYSA-N |
| Molecular Weight | 330.468 g/mol |
| SMILES | OCC12C3CCC4(C(C(C)=O)CCC4C3CCC2=CC(=O)CC1)C |
| SPLASH | splash10-0f6x-9713000000-8d8e28e355f7484de486 |
| Source of Spectrum | EP-1362-0-0 |
| Synonyms | 19-Hydroxypregn-4-ene-3,20-dione 17-acetyl-10-(hydroxymethyl)-13-methyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one 17-acetyl-13-methyl-10-methylol-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one 17-ethanoyl-10-(hydroxymethyl)-13-methyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one |
| Wiley ID | 1328187 |