| SpectraBase Compound ID | 5xKNG5cicyF |
|---|---|
| InChI | InChI=1S/C18H18N2O2/c21-17-8-4-7-16-15-9-13(11-20(16)17)10-19(12-15)18(22)14-5-2-1-3-6-14/h1-8,13,15H,9-12H2/t13-,15+/m0/s1 |
| InChIKey | HODDQHCNQOBZKP-DZGCQCFKSA-N |
| Mol Weight | 294.35 g/mol |
| Molecular Formula | C18H18N2O2 |
| Exact Mass | 294.136828 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | BbADHZ5YK9S |
|---|---|
| Name | (-)-N-benzoylcytisine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 294.136827826 u |
| Formula | C18H18N2O2 |
| InChI | InChI=1S/C18H18N2O2/c21-17-8-4-7-16-15-9-13(11-20(16)17)10-19(12-15)18(22)14-5-2-1-3-6-14/h1-8,13,15H,9-12H2/t13-,15+/m0/s1 |
| InChIKey | HODDQHCNQOBZKP-DZGCQCFKSA-N |
| Molecular Weight | 294.354 g/mol |
| SMILES | [C@@]12([H])CN(C[C@]([H])(C=3N(C2)C(=O)C=CC3)C1)C(C1=CC=CC=C1)=O |