| SpectraBase Compound ID | 5rkro0HA7Td |
|---|---|
| InChI | InChI=1S/C18H30N2O/c1-3-5-7-8-9-10-16-20(15-6-4-2)18(21)17-11-13-19-14-12-17/h11-14H,3-10,15-16H2,1-2H3 |
| InChIKey | YWSHKYKKOHVKCD-UHFFFAOYSA-N |
| Mol Weight | 290.45 g/mol |
| Molecular Formula | C18H30N2O |
| Exact Mass | 290.235814 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AdDbZ3Sfsg3 |
|---|---|
| Name | Isonicotinamide, N-butyl-N-octyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 290.235813593 u |
| Formula | C18H30N2O |
| InChI | InChI=1S/C18H30N2O/c1-3-5-7-8-9-10-16-20(15-6-4-2)18(21)17-11-13-19-14-12-17/h11-14H,3-10,15-16H2,1-2H3 |
| InChIKey | YWSHKYKKOHVKCD-UHFFFAOYSA-N |
| Molecular Weight | 290.451 g/mol |
| SMILES | C(C1=CC=NC=C1)(=O)N(CCCC)CCCCCCCC |