| SpectraBase Compound ID | GqN1uWMdRCU |
|---|---|
| InChI | InChI=1S/C21H36O3/c1-12(22)16-6-7-17-15-5-4-13-10-14(23)8-9-20(13,2)18(15)11-19(24)21(16,17)3/h12-19,22-24H,4-11H2,1-3H3/t12-,13+,14+,15-,16+,17-,18-,19-,20-,21+/m0/s1 |
| InChIKey | RQEARZOQNXJYMX-WMXRMNJCSA-N |
| Mol Weight | 336.5 g/mol |
| Molecular Formula | C21H36O3 |
| Exact Mass | 336.266445 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1PPC4AQnqLU |
|---|---|
| Name | 5β-pregnane-3α,12α,20α-triol |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H36O3 |
| InChI | InChI=1S/C21H36O3/c1-12(22)16-6-7-17-15-5-4-13-10-14(23)8-9-20(13,2)18(15)11-19(24)21(16,17)3/h12-19,22-24H,4-11H2,1-3H3/t12-,13+,14+,15-,16+,17-,18-,19-,20-,21+/m0/s1 |
| InChIKey | RQEARZOQNXJYMX-WMXRMNJCSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 40631M |
| Solvent | CDCl3 |