![2-[(E)-2-(2-furanyl)ethenyl]benzoic acid methyl ester](/api/spectrum/7dFWVr2MVcD/structure.png?h=300&w=458 "2-[(E)-2-(2-furanyl)ethenyl]benzoic acid methyl ester")
| SpectraBase Compound ID | KFduS01MBSO |
|---|---|
| InChI | InChI=1S/C14H12O3/c1-16-14(15)13-7-3-2-5-11(13)8-9-12-6-4-10-17-12/h2-10H,1H3/b9-8+ |
| InChIKey | FWXPNONWAKCIBO-CMDGGOBGSA-N |
| Mol Weight | 228.25 g/mol |
| Molecular Formula | C14H12O3 |
| Exact Mass | 228.078644 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7dFWVr2MVcD |
|---|---|
| Name | 2-[(E)-2-(2-Furanyl)ethenyl]benzoic acid methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 228.078644243 u |
| Formula | C14H12O3 |
| InChI | InChI=1S/C14H12O3/c1-16-14(15)13-7-3-2-5-11(13)8-9-12-6-4-10-17-12/h2-10H,1H3/b9-8+ |
| InChIKey | FWXPNONWAKCIBO-CMDGGOBGSA-N |
| Molecular Weight | 228.247 g/mol |
| SMILES | C(C=1C(\C=C\C=2OC=CC2)=CC=CC1)(=O)OC |