| SpectraBase Compound ID | 1mBWyKBk7DD |
|---|---|
| InChI | InChI=1S/C19H27NO4/c1-18-9-7-13(24-20(22)23)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h3,13-16H,4-11H2,1-2H3 |
| InChIKey | GVVCPFLFEQIUKY-UHFFFAOYSA-N |
| Mol Weight | 333.43 g/mol |
| Molecular Formula | C19H27NO4 |
| Exact Mass | 333.194008 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4TygdPcRuN1 |
|---|---|
| Name | 3-Nitryloxy-androst-5-en-17-on |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 333.194008349 u |
| Formula | C19H27NO4 |
| InChI | InChI=1S/C19H27NO4/c1-18-9-7-13(24-20(22)23)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h3,13-16H,4-11H2,1-2H3 |
| InChIKey | GVVCPFLFEQIUKY-UHFFFAOYSA-N |
| Molecular Weight | 333.428 g/mol |
| SMILES | C1C2C3C(C(=O)CC3)(CCC2C2(C(=C1)CC(ON(=O)=O)CC2)C)C |