| SpectraBase Compound ID | 7Zovxy2jEjL |
|---|---|
| InChI | InChI=1S/C21H27F5O2/c1-17-9-10-19(28,20(22,23)21(24,25)26)11-12(17)3-4-13-14-5-6-16(27)18(14,2)8-7-15(13)17/h11,13-15,28H,3-10H2,1-2H3/t13-,14-,15-,17-,18-,19-/m0/s1 |
| InChIKey | PAMMEAVLAHFSLO-HQRJMKCBSA-N |
| Mol Weight | 406.44 g/mol |
| Molecular Formula | C21H27F5O2 |
| Exact Mass | 406.193121 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2XpeKAal0W5 |
|---|---|
| Name | 3-ALPHA-PENTAFLUOROETHYL-3-BETA-HYDROXY-ANDROST-4-EN-17-ONE |
| Compound Number | 5A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H27F5O2 |
| InChI | InChI=1S/C21H27F5O2/c1-17-9-10-19(28,20(22,23)21(24,25)26)11-12(17)3-4-13-14-5-6-16(27)18(14,2)8-7-15(13)17/h11,13-15,28H,3-10H2,1-2H3/t13-,14-,15-,17-,18-,19-/m0/s1 |
| InChIKey | PAMMEAVLAHFSLO-HQRJMKCBSA-N |
| Literature Reference Author | J.R.WILLIAMS,T.J.SHEA |
| Literature Reference Citation | STEROIDS,61,50(1996) |
| Literature Reference DOI | 10.1016/0039-128x(95)00176-q |
| Molecular Weight | 406.436 g/mol |
| Sample ID | 968628 |
| Solvent | CDCl3 |