| SpectraBase Compound ID | 94hv5hNzzES |
|---|---|
| InChI | InChI=1S/C13H13NO3/c1-10(15)14(11(2)16)13(17)9-8-12-6-4-3-5-7-12/h3-9H,1-2H3/b9-8+ |
| InChIKey | OAICXKMEAGQRES-CMDGGOBGSA-N |
| Mol Weight | 231.25 g/mol |
| Molecular Formula | C13H13NO3 |
| Exact Mass | 231.089543 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7ixSZo0JBol |
|---|---|
| Name | 2-Propenamide, N,N-diacetyl-3-phenyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 231.089543280 u |
| Formula | C13H13NO3 |
| InChI | InChI=1S/C13H13NO3/c1-10(15)14(11(2)16)13(17)9-8-12-6-4-3-5-7-12/h3-9H,1-2H3/b9-8+ |
| InChIKey | OAICXKMEAGQRES-CMDGGOBGSA-N |
| Molecular Weight | 231.251 g/mol |
| SMILES | C(N(C(=O)C)C(=O)C)(\C=C\C=1C=CC=CC1)=O |