| SpectraBase Compound ID | 4P4vincbyKY |
|---|---|
| InChI | InChI=1S/C20H33NO/c1-4-6-7-11-16-21(20(22)18(3)12-5-2)17-15-19-13-9-8-10-14-19/h8-10,13-14,18H,4-7,11-12,15-17H2,1-3H3 |
| InChIKey | YKAJQCIYFQMRLI-UHFFFAOYSA-N |
| Mol Weight | 303.5 g/mol |
| Molecular Formula | C20H33NO |
| Exact Mass | 303.256215 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ATsxpyctAXj |
|---|---|
| Name | Valeramide, 2-methyl-N-(2-phenylethyl)-N-hexyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 303.256214686 u |
| Formula | C20H33NO |
| InChI | InChI=1S/C20H33NO/c1-4-6-7-11-16-21(20(22)18(3)12-5-2)17-15-19-13-9-8-10-14-19/h8-10,13-14,18H,4-7,11-12,15-17H2,1-3H3 |
| InChIKey | YKAJQCIYFQMRLI-UHFFFAOYSA-N |
| SMILES | C1=CC=CC(=C1)CCN(C(=O)C(CCC)C)CCCCCC |