| SpectraBase Compound ID | 4f6m8WJaAcX |
|---|---|
| InChI | InChI=1S/C11H10N2O3/c14-10-5-6-12-11(7-10)8-1-3-9(4-2-8)13(15)16/h1-6,11-12H,7H2 |
| InChIKey | DOJPLVZFFBQIBX-UHFFFAOYSA-N |
| Mol Weight | 218.21 g/mol |
| Molecular Formula | C11H10N2O3 |
| Exact Mass | 218.069142 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3cRwKKwrCaI |
|---|---|
| Name | 2-(4-Nitrophenyl)-2,3-dihydro-1H-pyridin-4-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 218.069142187 u |
| Formula | C11H10N2O3 |
| InChI | InChI=1S/C11H10N2O3/c14-10-5-6-12-11(7-10)8-1-3-9(4-2-8)13(15)16/h1-6,11-12H,7H2 |
| InChIKey | DOJPLVZFFBQIBX-UHFFFAOYSA-N |
| Molecular Weight | 218.212 g/mol |
| SMILES | C1(CC(C=CN1)=O)C=1C=CC(=CC1)N(=O)=O |