| SpectraBase Compound ID | 5YNtvXOVrGt |
|---|---|
| InChI | InChI=1S/C21H34O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h14-19,23H,4-12H2,1-3H3/t14-,15+,16+,17-,18+,19+,20+,21-/m1/s1 |
| InChIKey | AURFZBICLPNKBZ-GRWISUQFSA-N |
| Mol Weight | 318.5 g/mol |
| Molecular Formula | C21H34O2 |
| Exact Mass | 318.25588 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9hpN2NghEoO |
|---|---|
| Name | 3-BETA-HYDROXY-5-BETA-PREGNANE-20-ONE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H34O2 |
| InChI | InChI=1S/C21H34O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h14-19,23H,4-12H2,1-3H3/t14-,15+,16+,17-,18+,19+,20+,21-/m1/s1 |
| InChIKey | AURFZBICLPNKBZ-GRWISUQFSA-N |
| Literature Reference Author | S.H.HU,G.GENAIN,R.AZERAD |
| Literature Reference Citation | STEROIDS,60,337(1995) |
| Literature Reference DOI | 10.1016/0039-128x(95)00006-c |
| Molecular Weight | 318.500 g/mol |
| Sample ID | 968611 |
| Solvent | CDCl3 |