| SpectraBase Compound ID | EwawrEm5ZdJ |
|---|---|
| InChI | InChI=1S/C17H16O3/c1-2-20-16(18)12-13-8-10-15(11-9-13)17(19)14-6-4-3-5-7-14/h3-11H,2,12H2,1H3 |
| InChIKey | UAEQZVBNAXBJLE-UHFFFAOYSA-N |
| Mol Weight | 268.31 g/mol |
| Molecular Formula | C17H16O3 |
| Exact Mass | 268.109944 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7cYZjfIlXQY |
|---|---|
| Name | Ethyl 2-(4-benzoylphenyl)acetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 268.109944372 u |
| Formula | C17H16O3 |
| InChI | InChI=1S/C17H16O3/c1-2-20-16(18)12-13-8-10-15(11-9-13)17(19)14-6-4-3-5-7-14/h3-11H,2,12H2,1H3 |
| InChIKey | UAEQZVBNAXBJLE-UHFFFAOYSA-N |
| Molecular Weight | 268.312 g/mol |
| SMILES | C(CC=1C=CC(=CC1)C(C=1C=CC=CC1)=O)(=O)OCC |