| SpectraBase Compound ID | Kdo2BWlaAQV |
|---|---|
| InChI | InChI=1S/C21H30O2/c1-12-10-15(23)11-14-4-5-16-17(20(12)14)8-9-21(3)18(13(2)22)6-7-19(16)21/h11-12,16-20H,4-10H2,1-3H3 |
| InChIKey | XRGMDVOEEDQCFH-UHFFFAOYSA-N |
| Mol Weight | 314.47 g/mol |
| Molecular Formula | C21H30O2 |
| Exact Mass | 314.22458 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3tg12yzkUIG |
|---|---|
| Name | 19-Norpregn-4-ene-3,20-dione, 1-methyl-, (1.alpha.)- |
| CAS Registry Number | 4183-69-1 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H30O2 |
| InChI | InChI=1S/C21H30O2/c1-12-10-15(23)11-14-4-5-16-17(20(12)14)8-9-21(3)18(13(2)22)6-7-19(16)21/h11-12,16-20H,4-10H2,1-3H3 |
| InChIKey | XRGMDVOEEDQCFH-UHFFFAOYSA-N |
| Molecular Weight | 314.469 g/mol |
| SMILES | CC12C(C3C(CC2)C2C(CC3)=CC(CC2C)=O)CCC1C(C)=O |
| SPLASH | splash10-006x-7921000000-a6c1b87fb0cf7df3ec5c |
| Source of Spectrum | EP-1389-0-0 |
| Synonyms | 19-Norpregn-4-ene-3,20-dione, 1-methyl-, (1.beta.)- 17-Acetyl-1-methylestr-4-en-3-one 17-acetyl-1,13-dimethyl-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-one 17-ethanoyl-1,13-dimethyl-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-one |
| Wiley ID | 1315502 |