![[1,1'-Biphenyl]-2-carboxylic acid, 2-oxo-2-phenylethyl ester](/api/spectrum/EU6ACBr2ixy/structure.png?h=300&w=458 "[1,1'-Biphenyl]-2-carboxylic acid, 2-oxo-2-phenylethyl ester")
| SpectraBase Compound ID | AlAqsa35cIk |
|---|---|
| InChI | InChI=1S/C21H16O3/c22-20(17-11-5-2-6-12-17)15-24-21(23)19-14-8-7-13-18(19)16-9-3-1-4-10-16/h1-14H,15H2 |
| InChIKey | QGTZDOXHDQBPKT-UHFFFAOYSA-N |
| Mol Weight | 316.36 g/mol |
| Molecular Formula | C21H16O3 |
| Exact Mass | 316.109944 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EU6ACBr2ixy |
|---|---|
| Name | [1,1'-Biphenyl]-2-carboxylic acid, 2-oxo-2-phenylethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 316.109944372 u |
| Formula | C21H16O3 |
| InChI | InChI=1S/C21H16O3/c22-20(17-11-5-2-6-12-17)15-24-21(23)19-14-8-7-13-18(19)16-9-3-1-4-10-16/h1-14H,15H2 |
| InChIKey | QGTZDOXHDQBPKT-UHFFFAOYSA-N |
| Molecular Weight | 316.356 g/mol |
| SMILES | C(OCC(=O)C=1C=CC=CC1)(C1=CC=CC=C1C1=CC=CC=C1)=O |