| SpectraBase Compound ID | 6KaL5qKLtXZ |
|---|---|
| InChI | InChI=1S/C21H32O2/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/h14,16-19H,4-12H2,1-3H3/t14-,16+,17-,18+,19+,20+,21-/m1/s1 |
| InChIKey | XMRPGKVKISIQBV-XWOJZHJZSA-N |
| Mol Weight | 316.5 g/mol |
| Molecular Formula | C21H32O2 |
| Exact Mass | 316.24023 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 5Xb3WWW18Q3 |
|---|---|
| Name | 5-BETA-PREGNANE-3,20-DIONE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H32O2 |
| InChI | InChI=1S/C21H32O2/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/h14,16-19H,4-12H2,1-3H3/t14-,16+,17-,18+,19+,20+,21-/m1/s1 |
| InChIKey | XMRPGKVKISIQBV-XWOJZHJZSA-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 | 316.484 g/mol |
| Sample ID | 968609 |
| Solvent | CDCl3 |