| SpectraBase Compound ID | 3d3gxZewcHK |
|---|---|
| InChI | InChI=1S/C15H12O3/c1-10-5-4-6-11(9-10)14(16)12-7-2-3-8-13(12)15(17)18/h2-9H,1H3,(H,17,18) |
| InChIKey | GVSLNMMHEAMXAJ-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 | 4L9zvo1bOgL |
|---|---|
| Name | 2-(3-Methylbenzoyl)benzoic acid |
| 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/c1-10-5-4-6-11(9-10)14(16)12-7-2-3-8-13(12)15(17)18/h2-9H,1H3,(H,17,18) |
| InChIKey | GVSLNMMHEAMXAJ-UHFFFAOYSA-N |
| Molecular Weight | 240.258 g/mol |
| SMILES | CC=1C=CC=C(C1)C(C1=CC=CC=C1C(O)=O)=O |