| SpectraBase Compound ID | 78uVs1t61eW |
|---|---|
| InChI | InChI=1S/C19H31NO2/c1-18-9-7-13(20-22)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12,14-17,21-22H,3-11H2,1-2H3/b20-13+/t12-,14-,15-,16-,17-,18-,19-/m0/s1 |
| InChIKey | VHLNMRCAXRWHOK-FMPYOAEHSA-N |
| Mol Weight | 305.46 g/mol |
| Molecular Formula | C19H31NO2 |
| Exact Mass | 305.235479 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7avmNZLHl3S |
|---|---|
| Name | 17.beta.-Hydroxy-5.alpha.-androstan-3-one oxime |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 305.235479240 u |
| Formula | C19H31NO2 |
| InChI | InChI=1S/C19H31NO2/c1-18-9-7-13(20-22)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12,14-17,21-22H,3-11H2,1-2H3/b20-13+/t12-,14-,15-,16-,17-,18-,19-/m0/s1 |
| InChIKey | VHLNMRCAXRWHOK-FMPYOAEHSA-N |
| Molecular Weight | 305.462 g/mol |
| SMILES | C1\C(CC[C@]2([C@]1(CC[C@@]1([C@@]2(CC[C@]2([C@]1(CC[C@@]2(O)[H])[H])C)[H])[H])[H])C)=N\O |