| SpectraBase Compound ID | DOhm9VzenDJ |
|---|---|
| InChI | InChI=1S/C21H25F5O/c1-18-9-7-13(20(22,23)21(24,25)26)11-12(18)3-4-14-15-5-6-17(27)19(15,2)10-8-16(14)18/h3,11,14-16H,4-10H2,1-2H3/t14-,15-,16-,18-,19-/m0/s1 |
| InChIKey | JFLZBXOPSQFRKD-QAGGRKNESA-N |
| Mol Weight | 388.42 g/mol |
| Molecular Formula | C21H25F5O |
| Exact Mass | 388.182556 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3PN9mD2iA74 |
|---|---|
| Name | 3-PENTAFLUOROETHYL-ANDROSTA-3,5-DIEN-17-ONE |
| Compound Number | 8A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H25F5O |
| InChI | InChI=1S/C21H25F5O/c1-18-9-7-13(20(22,23)21(24,25)26)11-12(18)3-4-14-15-5-6-17(27)19(15,2)10-8-16(14)18/h3,11,14-16H,4-10H2,1-2H3/t14-,15-,16-,18-,19-/m0/s1 |
| InChIKey | JFLZBXOPSQFRKD-QAGGRKNESA-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 | 388.421 g/mol |
| Sample ID | 968637 |
| Solvent | CDCl3 |