| SpectraBase Compound ID | 6GsmwDMfQfd |
|---|---|
| InChI | InChI=1S/C21H34O/c1-4-14-13-18(22)19-16-9-8-15-7-5-6-11-20(15,2)17(16)10-12-21(14,19)3/h14-17,19H,4-13H2,1-3H3/t14-,15+,16+,17-,19+,20-,21+/m0/s1 |
| InChIKey | IJFGLPBXLYRFEJ-GIXGDULASA-N |
| Mol Weight | 302.5 g/mol |
| Molecular Formula | C21H34O |
| Exact Mass | 302.260966 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Kcz22HpR0aT |
|---|---|
| Name | 5.alpha.-Pregnan-15-one |
| CAS Registry Number | 14012-13-6 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H34O |
| InChI | InChI=1S/C21H34O/c1-4-14-13-18(22)19-16-9-8-15-7-5-6-11-20(15,2)17(16)10-12-21(14,19)3/h14-17,19H,4-13H2,1-3H3/t14-,15+,16+,17-,19+,20-,21+/m0/s1 |
| InChIKey | IJFGLPBXLYRFEJ-GIXGDULASA-N |
| Molecular Weight | 302.502 g/mol |
| SMILES | [C@]12([C@]3([C@]([C@@]4(C)CCCC[C@@]4(CC3)[H])([H])CC[C@@]2([C@](CC)([H])CC1=O)C)[H])[H] |
| SPLASH | splash10-0006-9510000000-aa004a81d641c26f29b5 |
| Source of Spectrum | SD-1981-0-0 |
| Synonyms | (5alpha)-pregnan-15-one |
| Wiley ID | 1305250 |