| SpectraBase Compound ID | l0qlDr9eXC |
|---|---|
| InChI | InChI=1S/C25H34O2S/c1-24-13-12-20-18(19(24)10-11-23(24)27)9-8-16-14-22(21(26)15-25(16,20)2)28-17-6-4-3-5-7-17/h3-7,16,18-22,26H,8-15H2,1-2H3/t16?,18-,19-,20-,21-,22-,24-,25-/m0/s1 |
| InChIKey | ZTCSYNMOCGDCAK-DZBUMHMCSA-N |
| Mol Weight | 398.6 g/mol |
| Molecular Formula | C25H34O2S |
| Exact Mass | 398.227952 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5cm5sFiaS2L |
|---|---|
| Name | 2.beta.-Hydroxy-3.alpha.-phenylthioandrostan-17-one |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C25H34O2S |
| InChI | InChI=1S/C25H34O2S/c1-24-13-12-20-18(19(24)10-11-23(24)27)9-8-16-14-22(21(26)15-25(16,20)2)28-17-6-4-3-5-7-17/h3-7,16,18-22,26H,8-15H2,1-2H3/t16?,18-,19-,20-,21-,22-,24-,25-/m0/s1 |
| InChIKey | ZTCSYNMOCGDCAK-DZBUMHMCSA-N |
| Molecular Weight | 398.605 g/mol |
| SMILES | O[C@]1(C[C@@]2([C@@]3([C@@]([C@@]4(CCC([C@]4(CC3)C)=O)[H])([H])CCC2C[C@@]1(Sc1ccccc1)[H])[H])C)[H] |
| SPLASH | splash10-03di-0912000000-c576f4c01f8f105a13ce |
| Source of Spectrum | F4-41-4040-2a |
| Wiley ID | 1673274 |