| SpectraBase Compound ID | 7PFrRLwmzN |
|---|---|
| InChI | InChI=1S/C18H26O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h10,13-17,20H,2-9H2,1H3/t13-,14+,15+,16-,17-,18-/m0/s1 |
| InChIKey | NPAGDVCDWIYMMC-IZPLOLCNSA-N |
| Mol Weight | 274.4 g/mol |
| Molecular Formula | C18H26O2 |
| Exact Mass | 274.19328 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5vavlrDfPnQ |
|---|---|
| Name | (17beta)-17-hydroxyestr-4-en-3-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H26O2 |
| InChI | InChI=1S/C18H26O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h10,13-17,20H,2-9H2,1H3/t13-,14+,15+,16-,17-,18-/m0/s1 |
| InChIKey | NPAGDVCDWIYMMC-IZPLOLCNSA-N |
| Molecular Weight | 274.404 g/mol |
| SMILES | O[C@@]1([C@@]2([C@]([C@@]3(CCC=4[C@@]([C@]3(CC2)[H])(CCC(=O)C4)[H])[H])(CC1)[H])C)[H] |
| SPLASH | splash10-03di-1910000000-1c45580fc8b8b2d05a7b |
| Source of Spectrum | JZ-1992-2221-0 |
| Synonyms | (8R,9S,10R,13S,14S,17S)-13-methyl-17-oxidanyl-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-one (8R,9S,10R,13S,14S,17S)-17-hydroxy-13-methyl-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-one |
| Wiley ID | 1278520 |