| SpectraBase Compound ID | 6Rtk0woisyz |
|---|---|
| InChI | InChI=1S/C14H21NO/c1-4-15(14(16)10-12(2)3)11-13-8-6-5-7-9-13/h5-9,12H,4,10-11H2,1-3H3 |
| InChIKey | RBBQDBQYQVWRFE-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 | JdKv3POOlzZ |
|---|---|
| Name | Isovaleramide, N-benzyl-N-ethyl- |
| 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/c1-4-15(14(16)10-12(2)3)11-13-8-6-5-7-9-13/h5-9,12H,4,10-11H2,1-3H3 |
| InChIKey | RBBQDBQYQVWRFE-UHFFFAOYSA-N |
| Molecular Weight | 219.328 g/mol |
| SMILES | C(N(CC)CC1=CC=CC=C1)(=O)CC(C)C |