| SpectraBase Compound ID | G7GAfHOp0N6 |
|---|---|
| InChI | InChI=1S/C21H30O3/c1-12(22)16-5-6-17-15-4-3-13-9-14(23)7-8-21(13)11-24-18(19(15)21)10-20(16,17)2/h9,12,15-19,22H,3-8,10-11H2,1-2H3/t12-,15-,16+,17-,18?,19+,20+,21+/m0/s1 |
| InChIKey | NNJBSSDOSYGCJI-WUSFZBINSA-N |
| Mol Weight | 330.47 g/mol |
| Molecular Formula | C21H30O3 |
| Exact Mass | 330.219495 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4PZW7UvHX3u |
|---|---|
| Name | 20-BETA-HYDROXY-11,19-OXIDO-PREGN-4-EN-3-ONE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H30O3 |
| InChI | InChI=1S/C21H30O3/c1-12(22)16-5-6-17-15-4-3-13-9-14(23)7-8-21(13)11-24-18(19(15)21)10-20(16,17)2/h9,12,15-19,22H,3-8,10-11H2,1-2H3/t12-,15-,16+,17-,18?,19+,20+,21+/m0/s1 |
| InChIKey | NNJBSSDOSYGCJI-WUSFZBINSA-N |
| Literature Reference Author | M.O.V.B.DOCTOROVICH,A.A.GHINI,G.BURTON |
| Literature Reference Citation | STEROIDS,61,345(1996) |
| Literature Reference DOI | 10.1016/0039-128x(96)00034-7 |
| Molecular Weight | 330.467 g/mol |
| Sample ID | 968649 |
| Solvent | CDCl3 |