| SpectraBase Compound ID | 3DDILI62YSL |
|---|---|
| InChI | InChI=1S/C16H30N2O/c1-3-5-7-9-12-16(19)18(15-11-13-17)14-10-8-6-4-2/h3-12,14-15H2,1-2H3 |
| InChIKey | LCECBCYVYGCMDO-UHFFFAOYSA-N |
| Mol Weight | 266.43 g/mol |
| Molecular Formula | C16H30N2O |
| Exact Mass | 266.235814 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | BOfvZWrzt3f |
|---|---|
| Name | Heptanamide, N-(2-cyanoethyl)-N-hexyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 266.235813593 u |
| Formula | C16H30N2O |
| InChI | InChI=1S/C16H30N2O/c1-3-5-7-9-12-16(19)18(15-11-13-17)14-10-8-6-4-2/h3-12,14-15H2,1-2H3 |
| InChIKey | LCECBCYVYGCMDO-UHFFFAOYSA-N |
| Molecular Weight | 266.429 g/mol |
| SMILES | C(N(CCCCCC)CCC#N)(CCCCCC)=O |