| SpectraBase Compound ID | 3xyOMqcCkqx |
|---|---|
| InChI | InChI=1S/C13H15NO4/c1-3-18-11-6-4-10(5-7-11)8-12(13(16)17)14-9(2)15/h4-8H,3H2,1-2H3,(H,14,15)(H,16,17)/b12-8- |
| InChIKey | LSNPIFRBNKQULM-WQLSENKSSA-N |
| Mol Weight | 249.27 g/mol |
| Molecular Formula | C13H15NO4 |
| Exact Mass | 249.100108 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Lq6lGV4PxhH |
|---|---|
| Name | 2-Acetylamino-3-(4-ethoxy-phenyl)-acrylic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 249.100107963 u |
| Formula | C13H15NO4 |
| InChI | InChI=1S/C13H15NO4/c1-3-18-11-6-4-10(5-7-11)8-12(13(16)17)14-9(2)15/h4-8H,3H2,1-2H3,(H,14,15)(H,16,17)/b12-8- |
| InChIKey | LSNPIFRBNKQULM-WQLSENKSSA-N |
| Molecular Weight | 249.266 g/mol |
| SMILES | C(\C(NC(=O)C)=C\C1=CC=C(C=C1)OCC)(=O)O |