| SpectraBase Compound ID | Ay2YHqyVfWU |
|---|---|
| InChI | InChI=1S/C20H34N2O/c1-3-5-7-9-11-17-22(18-12-10-8-6-4-2)20(23)19-13-15-21-16-14-19/h13-16H,3-12,17-18H2,1-2H3 |
| InChIKey | NVRWTGYHNXQINS-UHFFFAOYSA-N |
| Mol Weight | 318.5 g/mol |
| Molecular Formula | C20H34N2O |
| Exact Mass | 318.267114 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J3h4ipS6s4w |
|---|---|
| Name | Isonicotinamide, N,N-diheptyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 318.267113722 u |
| Formula | C20H34N2O |
| InChI | InChI=1S/C20H34N2O/c1-3-5-7-9-11-17-22(18-12-10-8-6-4-2)20(23)19-13-15-21-16-14-19/h13-16H,3-12,17-18H2,1-2H3 |
| InChIKey | NVRWTGYHNXQINS-UHFFFAOYSA-N |
| Molecular Weight | 318.505 g/mol |
| SMILES | CCCCCCCN(C(C1=CC=NC=C1)=O)CCCCCCC |