| SpectraBase Compound ID | 3kvfgI2DCCa |
|---|---|
| InChI | InChI=1S/C13H25NO/c1-3-5-7-9-11-13(15)14-12-10-8-6-4-2/h9,11H,3-8,10,12H2,1-2H3,(H,14,15)/b11-9+ |
| InChIKey | WNNIQLWRCRNXHQ-PKNBQFBNSA-N |
| Mol Weight | 211.35 g/mol |
| Molecular Formula | C13H25NO |
| Exact Mass | 211.193614 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5WVJdHJYqAH |
|---|---|
| Name | Hept-2-enoylamide, N-hexyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 211.193614428 u |
| Formula | C13H25NO |
| InChI | InChI=1S/C13H25NO/c1-3-5-7-9-11-13(15)14-12-10-8-6-4-2/h9,11H,3-8,10,12H2,1-2H3,(H,14,15)/b11-9+ |
| InChIKey | WNNIQLWRCRNXHQ-PKNBQFBNSA-N |
| Molecular Weight | 211.349 g/mol |
| SMILES | C(=O)(NCCCCCC)\C=C\CCCC |