| SpectraBase Compound ID | Hk1vRqsMYI5 |
|---|---|
| InChI | InChI=1S/C21H32Br2O3/c1-19-8-5-13(24)11-12(19)3-4-14-15(19)6-9-20(2)16(14)7-10-21(20,26)17(25)18(22)23/h12-16,18,24,26H,3-11H2,1-2H3/t12-,13-,14-,15+,16+,19+,20+,21+/m1/s1 |
| InChIKey | GCJHPEZGHQXPBV-TVXZDGNRSA-N |
| Mol Weight | 492.3 g/mol |
| Molecular Formula | C21H32Br2O3 |
| Exact Mass | 490.071821 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8tyv5NKQUrZ |
|---|---|
| Name | 21,21-Dibromo-3 α,17-dihydroxy-5 β-pregnan-20-one |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H32Br2O3 |
| InChI | InChI=1S/C21H32Br2O3/c1-19-8-5-13(24)11-12(19)3-4-14-15(19)6-9-20(2)16(14)7-10-21(20,26)17(25)18(22)23/h12-16,18,24,26H,3-11H2,1-2H3/t12-,13-,14-,15+,16+,19+,20+,21+/m1/s1 |
| InChIKey | GCJHPEZGHQXPBV-TVXZDGNRSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 39953M |
| Solvent | CDCl3 |