![Heptanamide, N-[3-(acetylamino)propyl]-N-hexyl-](/api/spectrum/JhfTp8xOVdr/structure.png?h=300&w=458 "Heptanamide, N-[3-(acetylamino)propyl]-N-hexyl-")
| SpectraBase Compound ID | JRTgCCcZfF |
|---|---|
| InChI | InChI=1S/C18H36N2O2/c1-4-6-8-10-13-18(22)20(15-11-9-7-5-2)16-12-14-19-17(3)21/h4-16H2,1-3H3,(H,19,21) |
| InChIKey | UJNITTNWNQREPF-UHFFFAOYSA-N |
| Mol Weight | 312.5 g/mol |
| Molecular Formula | C18H36N2O2 |
| Exact Mass | 312.277678 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JhfTp8xOVdr |
|---|---|
| Name | Heptanamide, N-[3-(acetylamino)propyl]-N-hexyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 312.277678405 u |
| Formula | C18H36N2O2 |
| InChI | InChI=1S/C18H36N2O2/c1-4-6-8-10-13-18(22)20(15-11-9-7-5-2)16-12-14-19-17(3)21/h4-16H2,1-3H3,(H,19,21) |
| InChIKey | UJNITTNWNQREPF-UHFFFAOYSA-N |
| Molecular Weight | 312.498 g/mol |
| SMILES | C(N(CCCNC(C)=O)CCCCCC)(CCCCCC)=O |