| SpectraBase Compound ID | AcRQmVZn5Ge |
|---|---|
| InChI | InChI=1S/C16H31NO/c1-4-7-9-11-13-16(18)17(14-6-3)15-12-10-8-5-2/h7,9H,4-6,8,10-15H2,1-3H3/b9-7+ |
| InChIKey | KRKYFUUMKQKPHY-VQHVLOKHSA-N |
| Mol Weight | 253.43 g/mol |
| Molecular Formula | C16H31NO |
| Exact Mass | 253.240565 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4vVjQRvzPNv |
|---|---|
| Name | Hept-4-enoylamide, N-propyl-N-hexyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 253.240564621 u |
| Formula | C16H31NO |
| InChI | InChI=1S/C16H31NO/c1-4-7-9-11-13-16(18)17(14-6-3)15-12-10-8-5-2/h7,9H,4-6,8,10-15H2,1-3H3/b9-7+ |
| InChIKey | KRKYFUUMKQKPHY-VQHVLOKHSA-N |
| Molecular Weight | 253.430 g/mol |
| SMILES | C(\C=C\CCC(N(CCCCCC)CCC)=O)C |