| SpectraBase Compound ID | IFxHqWD2pFT |
|---|---|
| InChI | InChI=1S/C19H20N2O/c22-14-6-5-12-11-21-8-7-16-15-3-1-2-4-17(15)20-19(16)18(21)10-13(12)9-14/h1-6,12-13,18,20H,7-11H2 |
| InChIKey | FRIRDXVLZFWNRG-UHFFFAOYSA-N |
| Mol Weight | 292.38 g/mol |
| Molecular Formula | C19H20N2O |
| Exact Mass | 292.157563 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | G0JTZmY19Vj |
|---|---|
| Name | Yohimban-17-one, 18,19-didehydro- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 292.157563271 u |
| Formula | C19H20N2O |
| InChI | InChI=1S/C19H20N2O/c22-14-6-5-12-11-21-8-7-16-15-3-1-2-4-17(15)20-19(16)18(21)10-13(12)9-14/h1-6,12-13,18,20H,7-11H2 |
| InChIKey | FRIRDXVLZFWNRG-UHFFFAOYSA-N |
| SMILES | C1(=O)CC2CC3C4=C(C5=CC=CC=C5N4)CCN3CC2C=C1 |