| SpectraBase Compound ID | H8zFumWZOEa |
|---|---|
| InChI | InChI=1S/C15H12O3/c1-18-15(17)14-9-5-4-8-13(14)12-7-3-2-6-11(12)10-16/h2-10H,1H3 |
| InChIKey | RGAKSWUMKFLWCI-UHFFFAOYSA-N |
| Mol Weight | 240.26 g/mol |
| Molecular Formula | C15H12O3 |
| Exact Mass | 240.078644 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DcimvSzg495 |
|---|---|
| Name | 2-(2-Formylphenyl)benzoic acid methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 240.078644243 u |
| Formula | C15H12O3 |
| InChI | InChI=1S/C15H12O3/c1-18-15(17)14-9-5-4-8-13(14)12-7-3-2-6-11(12)10-16/h2-10H,1H3 |
| InChIKey | RGAKSWUMKFLWCI-UHFFFAOYSA-N |
| Molecular Weight | 240.258 g/mol |
| SMILES | COC(=O)C1=C(C=CC=C1)C1=C(C=O)C=CC=C1 |