| SpectraBase Compound ID | CwBy9wnU7MG |
|---|---|
| InChI | InChI=1S/C11H12N2O3/c1-8(9(2)14)7-12-10-3-5-11(6-4-10)13(15)16/h3-7,12H,1-2H3/b8-7+ |
| InChIKey | YCVQRIWFQXRACK-BQYQJAHWSA-N |
| Mol Weight | 220.23 g/mol |
| Molecular Formula | C11H12N2O3 |
| Exact Mass | 220.084792 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4De9ZnEIOov |
|---|---|
| Name | 1,2-Dimethyl-3-(4-nitrophenylamino)propen-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 220.084792251 u |
| Formula | C11H12N2O3 |
| InChI | InChI=1S/C11H12N2O3/c1-8(9(2)14)7-12-10-3-5-11(6-4-10)13(15)16/h3-7,12H,1-2H3/b8-7+ |
| InChIKey | YCVQRIWFQXRACK-BQYQJAHWSA-N |
| Molecular Weight | 220.228 g/mol |
| SMILES | C(\C(=C\NC=1C=CC(=CC1)N(=O)=O)C)(=O)C |