| SpectraBase Compound ID | DZKtnnUt9sa |
|---|---|
| InChI | InChI=1S/C21H33NO2/c1-4-24-22-15-9-11-20(2)14(13-15)5-6-16-17-7-8-19(23)21(17,3)12-10-18(16)20/h13,16-19,23H,4-12H2,1-3H3/b22-15+ |
| InChIKey | YPQUOZLJDBTJFD-PXLXIMEGSA-N |
| Mol Weight | 331.5 g/mol |
| Molecular Formula | C21H33NO2 |
| Exact Mass | 331.251129 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LICUqZD98nu |
|---|---|
| Name | Epitestosterone, o-ethyloxime |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 331.251129305 u |
| Formula | C21H33NO2 |
| InChI | InChI=1S/C21H33NO2/c1-4-24-22-15-9-11-20(2)14(13-15)5-6-16-17-7-8-19(23)21(17,3)12-10-18(16)20/h13,16-19,23H,4-12H2,1-3H3/b22-15+ |
| InChIKey | YPQUOZLJDBTJFD-PXLXIMEGSA-N |
| Molecular Weight | 331.500 g/mol |
| SMILES | C12(C(C3C(CC2)C2(C(=C\C(CC2)=N\OCC)CC3)C)CCC1O)C |