| SpectraBase Spectrum ID |
VJrwGSCMLI |
| Name |
Heptanamide, N-[3-(acetylamino)propyl]-N-hexyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| 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 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.986712 |
![Heptanamide, N-[3-(acetylamino)propyl]-N-hexyl-](/api/spectrum/VJrwGSCMLI/structure.png?h=300&w=458 "Heptanamide, N-[3-(acetylamino)propyl]-N-hexyl-")
