| SpectraBase Compound ID | 8gYlSdCvOoa |
|---|---|
| InChI | InChI=1S/C23H32O2/c1-5-23(4,25)20-9-8-18-17-7-6-15-14-16(24)10-12-21(15,2)19(17)11-13-22(18,20)3/h1,14,17-20,25H,6-13H2,2-4H3 |
| InChIKey | CWPDWMCTZFGDGL-UHFFFAOYSA-N |
| Mol Weight | 340.5 g/mol |
| Molecular Formula | C23H32O2 |
| Exact Mass | 340.24023 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4cuSwQ16HHz |
|---|---|
| Name | 20-Ethynyl-4-pregnene-20-ol-3-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 340.240230268 u |
| Formula | C23H32O2 |
| InChI | InChI=1S/C23H32O2/c1-5-23(4,25)20-9-8-18-17-7-6-15-14-16(24)10-12-21(15,2)19(17)11-13-22(18,20)3/h1,14,17-20,25H,6-13H2,2-4H3 |
| InChIKey | CWPDWMCTZFGDGL-UHFFFAOYSA-N |
| Molecular Weight | 340.507 g/mol |
| SMILES | C(O)(C#C)(C)C1C2(C)CCC3C4(C)CCC(=O)C=C4CCC3C2CC1 |