| SpectraBase Compound ID | 8nfe10oUpY4 |
|---|---|
| InChI | InChI=1S/C12H15NO2/c1-8-4-5-11(6-9(8)2)13-12(15)7-10(3)14/h4-6H,7H2,1-3H3,(H,13,15) |
| InChIKey | KKSJXJUYTRVZNM-UHFFFAOYSA-N |
| Mol Weight | 205.26 g/mol |
| Molecular Formula | C12H15NO2 |
| Exact Mass | 205.110279 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I5cGGpLuyYp |
|---|---|
| Name | N-(3,4-Dimethylphenyl)-3-oxobutanamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 205.110278725 u |
| Formula | C12H15NO2 |
| InChI | InChI=1S/C12H15NO2/c1-8-4-5-11(6-9(8)2)13-12(15)7-10(3)14/h4-6H,7H2,1-3H3,(H,13,15) |
| InChIKey | KKSJXJUYTRVZNM-UHFFFAOYSA-N |
| Molecular Weight | 205.257 g/mol |
| SMILES | C1(NC(=O)CC(=O)C)=CC(=C(C=C1)C)C |