![(2E)-3-[5-(4-fluorophenyl)furan-2-yl]prop-2-enoic acid](/api/spectrum/D9eeOIsLn2C/structure.png?h=300&w=458 "(2E)-3-[5-(4-fluorophenyl)furan-2-yl]prop-2-enoic acid")
| SpectraBase Compound ID | JZnRj6MXxVP |
|---|---|
| InChI | InChI=1S/C13H9FO3/c14-10-3-1-9(2-4-10)12-7-5-11(17-12)6-8-13(15)16/h1-8H,(H,15,16)/b8-6+ |
| InChIKey | LHPYNYVABBATBM-SOFGYWHQSA-N |
| Mol Weight | 232.21 g/mol |
| Molecular Formula | C13H9FO3 |
| Exact Mass | 232.053572 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | D9eeOIsLn2C |
|---|---|
| Name | (2E)-3-[5-(4-Fluorophenyl)furan-2-yl]prop-2-enoic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 232.053572310 u |
| Formula | C13H9FO3 |
| InChI | InChI=1S/C13H9FO3/c14-10-3-1-9(2-4-10)12-7-5-11(17-12)6-8-13(15)16/h1-8H,(H,15,16)/b8-6+ |
| InChIKey | LHPYNYVABBATBM-SOFGYWHQSA-N |
| Molecular Weight | 232.210 g/mol |
| SMILES | C=1(OC(\C=C\C(=O)O)=CC1)C=1C=CC(=CC1)F |