| SpectraBase Compound ID | FdkgAhWxLGM |
|---|---|
| InChI | InChI=1S/C15H16N2O/c1-3-17(14-6-4-5-12(2)11-14)15(18)13-7-9-16-10-8-13/h4-11H,3H2,1-2H3 |
| InChIKey | XEAXCWYKTHEKCG-UHFFFAOYSA-N |
| Mol Weight | 240.31 g/mol |
| Molecular Formula | C15H16N2O |
| Exact Mass | 240.126263 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KHgsWxRUA0e |
|---|---|
| Name | Isonicotinamide, N-ethyl-N-(3-methylphenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 240.126263142 u |
| Formula | C15H16N2O |
| InChI | InChI=1S/C15H16N2O/c1-3-17(14-6-4-5-12(2)11-14)15(18)13-7-9-16-10-8-13/h4-11H,3H2,1-2H3 |
| InChIKey | XEAXCWYKTHEKCG-UHFFFAOYSA-N |
| Molecular Weight | 240.306 g/mol |
| SMILES | C1=NC=CC(=C1)C(N(CC)C1=CC(C)=CC=C1)=O |