![.beta.-Benzamido-.beta.-[2-furyl]propionic acid](/api/spectrum/CrwxaxsvgPo/structure.png?h=300&w=458 ".beta.-Benzamido-.beta.-[2-furyl]propionic acid")
| SpectraBase Compound ID | 5gGZmepe2Ip |
|---|---|
| InChI | InChI=1S/C14H13NO4/c16-13(17)9-11(12-7-4-8-19-12)15-14(18)10-5-2-1-3-6-10/h1-8,11H,9H2,(H,15,18)(H,16,17) |
| InChIKey | CAKAFIPQXDZUHV-UHFFFAOYSA-N |
| Mol Weight | 259.26 g/mol |
| Molecular Formula | C14H13NO4 |
| Exact Mass | 259.084458 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CrwxaxsvgPo |
|---|---|
| Name | .beta.-Benzamido-.beta.-[2-furyl]propionic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 259.084457899 u |
| Formula | C14H13NO4 |
| InChI | InChI=1S/C14H13NO4/c16-13(17)9-11(12-7-4-8-19-12)15-14(18)10-5-2-1-3-6-10/h1-8,11H,9H2,(H,15,18)(H,16,17) |
| InChIKey | CAKAFIPQXDZUHV-UHFFFAOYSA-N |
| Molecular Weight | 259.261 g/mol |
| SMILES | C=1(OC=CC1)C(NC(=O)C1=CC=CC=C1)CC(=O)O |