| SpectraBase Compound ID | LgYQ6DZxvwX |
|---|---|
| InChI | InChI=1S/C14H21NO/c1-2-12-15-14(16)11-7-6-10-13-8-4-3-5-9-13/h3-5,8-9H,2,6-7,10-12H2,1H3,(H,15,16) |
| InChIKey | PJTKXWJZUQUOSU-UHFFFAOYSA-N |
| Mol Weight | 219.33 g/mol |
| Molecular Formula | C14H21NO |
| Exact Mass | 219.162314 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DBfL5jhWfe0 |
|---|---|
| Name | Valeramide, 5-phenyl-N-propyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 219.162314299 u |
| Formula | C14H21NO |
| InChI | InChI=1S/C14H21NO/c1-2-12-15-14(16)11-7-6-10-13-8-4-3-5-9-13/h3-5,8-9H,2,6-7,10-12H2,1H3,(H,15,16) |
| InChIKey | PJTKXWJZUQUOSU-UHFFFAOYSA-N |
| Molecular Weight | 219.328 g/mol |
| SMILES | C(=O)(NCCC)CCCCC1=CC=CC=C1 |