| SpectraBase Compound ID | 4BJDGm3ps7X |
|---|---|
| InChI | InChI=1S/C21H36O3/c1-12(22)15-4-5-16-14-11-19(24)18-10-13(23)6-8-21(18,3)17(14)7-9-20(15,16)2/h12-19,22-24H,4-11H2,1-3H3/t12-,13+,14-,15+,16-,17-,18-,19-,20+,21+/m0/s1 |
| InChIKey | SWHHMTKXNOSPLE-CJCIAWFASA-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 | KljknHpDjHg |
|---|---|
| Name | 5β-pregnane-3α,6α,20α-triol |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H36O3 |
| InChI | InChI=1S/C21H36O3/c1-12(22)15-4-5-16-14-11-19(24)18-10-13(23)6-8-21(18,3)17(14)7-9-20(15,16)2/h12-19,22-24H,4-11H2,1-3H3/t12-,13+,14-,15+,16-,17-,18-,19-,20+,21+/m0/s1 |
| InChIKey | SWHHMTKXNOSPLE-CJCIAWFASA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 40632M |
| Solvent | CDCl3 |