| SpectraBase Compound ID | INL1wvwFrZe |
|---|---|
| InChI | InChI=1S/C28H47BrO2/c1-16(2)17(3)25(29)26(31)18(4)20-10-11-21-19-15-24(30)23-9-7-8-13-27(23,5)22(19)12-14-28(20,21)6/h16-23,25-26,31H,7-15H2,1-6H3/t17-,18+,19?,20?,21?,22?,23-,25+,26-,27-,28-/m0/s1 |
| InChIKey | XDTYFMGWUJOICB-WPSHVSDUSA-N |
| Mol Weight | 495.6 g/mol |
| Molecular Formula | C28H47BrO2 |
| Exact Mass | 494.275944 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6bUA6qHjeZZ |
|---|---|
| Name | (22R,23S)-23-BROMO-22-HYDROXY-5ALPHA-ERGOSTAN-6-ONE |
| Comments | 2—OØ |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C28H47BrO2 |
| InChI | InChI=1S/C28H47BrO2/c1-16(2)17(3)25(29)26(31)18(4)20-10-11-21-19-15-24(30)23-9-7-8-13-27(23,5)22(19)12-14-28(20,21)6/h16-23,25-26,31H,7-15H2,1-6H3/t17-,18+,19?,20?,21?,22?,23-,25+,26-,27-,28-/m0/s1 |
| InChIKey | XDTYFMGWUJOICB-WPSHVSDUSA-N |
| Instrument Name | Varian XL-200 |
| Literature Reference | V.CERNY, M.BUDESINSKY (1990) Coll.Czech.Chem.Comm.: v.55, N11, 2738-2755. |
| NMR Standard | CDCL3 |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 chloroform-d |