| SpectraBase Compound ID | A9q4gAi9Qf0 |
|---|---|
| InChI | InChI=1S/C10H11NO2/c1-7-4-3-5-9(6-7)10(13)11-8(2)12/h3-6H,1-2H3,(H,11,12,13) |
| InChIKey | UNEOWXFMZGINFH-UHFFFAOYSA-N |
| Mol Weight | 177.2 g/mol |
| Molecular Formula | C10H11NO2 |
| Exact Mass | 177.078979 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3zqsKjUzLHE |
|---|---|
| Name | N-Acetyl-3-methylbenzamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 177.078978596 u |
| Formula | C10H11NO2 |
| InChI | InChI=1S/C10H11NO2/c1-7-4-3-5-9(6-7)10(13)11-8(2)12/h3-6H,1-2H3,(H,11,12,13) |
| InChIKey | UNEOWXFMZGINFH-UHFFFAOYSA-N |
| Molecular Weight | 177.203 g/mol |
| SMILES | C1(C(NC(=O)C)=O)=CC(=CC=C1)C |