| SpectraBase Compound ID | CIqMhN6W0C8 |
|---|---|
| InChI | InChI=1S/C17H27NO/c1-2-3-4-10-15-18-17(19)14-9-8-13-16-11-6-5-7-12-16/h5-7,11-12H,2-4,8-10,13-15H2,1H3,(H,18,19) |
| InChIKey | CRKNFIKBRFMVHG-UHFFFAOYSA-N |
| Mol Weight | 261.41 g/mol |
| Molecular Formula | C17H27NO |
| Exact Mass | 261.209264 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DBAb89PDePh |
|---|---|
| Name | Valeramide, 5-phenyl-N-hexyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 261.209264492 u |
| Formula | C17H27NO |
| InChI | InChI=1S/C17H27NO/c1-2-3-4-10-15-18-17(19)14-9-8-13-16-11-6-5-7-12-16/h5-7,11-12H,2-4,8-10,13-15H2,1H3,(H,18,19) |
| InChIKey | CRKNFIKBRFMVHG-UHFFFAOYSA-N |
| Molecular Weight | 261.409 g/mol |
| SMILES | C(=O)(NCCCCCC)CCCCC1=CC=CC=C1 |