| SpectraBase Compound ID | CFhokRdpEKF |
|---|---|
| InChI | InChI=1S/C14H13NO3/c1-3-11-7-5-6-8-12(11)15-13(16)9-10-14(17)18-4-2/h1,5-10H,4H2,2H3,(H,15,16)/b10-9+ |
| InChIKey | FJOSTVHPJPUWAD-MDZDMXLPSA-N |
| Mol Weight | 243.26 g/mol |
| Molecular Formula | C14H13NO3 |
| Exact Mass | 243.089543 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IZkNUCGw8Ox |
|---|---|
| Name | Ethyl (E)-4-(2-ethynylphenylamino)-4-oxobut-2-enoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 243.089543280 u |
| Formula | C14H13NO3 |
| InChI | InChI=1S/C14H13NO3/c1-3-11-7-5-6-8-12(11)15-13(16)9-10-14(17)18-4-2/h1,5-10H,4H2,2H3,(H,15,16)/b10-9+ |
| InChIKey | FJOSTVHPJPUWAD-MDZDMXLPSA-N |
| Molecular Weight | 243.262 g/mol |
| SMILES | C(\C=C\C(OCC)=O)(=O)NC=1C(=CC=CC1)C#C |