| SpectraBase Compound ID | 4aWMqDJ4STV |
|---|---|
| InChI | InChI=1S/C17H25NO3/c1-13(2)7-5-4-6-8-17(20)18-12-14-9-10-15(19)16(11-14)21-3/h4-5,9-11,13,19H,6-8,12H2,1-3H3,(H,18,20)/b5-4+ |
| InChIKey | DUZOZWXPGKRAGO-SNAWJCMRSA-N |
| Mol Weight | 291.39 g/mol |
| Molecular Formula | C17H25NO3 |
| Exact Mass | 291.183444 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 41SZctpi6R8 |
|---|---|
| Name | (E)-7-Methyl-N-vanillyl-oct-4-enamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 291.183443666 u |
| Formula | C17H25NO3 |
| InChI | InChI=1S/C17H25NO3/c1-13(2)7-5-4-6-8-17(20)18-12-14-9-10-15(19)16(11-14)21-3/h4-5,9-11,13,19H,6-8,12H2,1-3H3,(H,18,20)/b5-4+ |
| InChIKey | DUZOZWXPGKRAGO-SNAWJCMRSA-N |
| SMILES | C=1(C(=CC=C(C1)CNC(=O)CC\C=C\CC(C)C)O)OC |