| SpectraBase Compound ID | Ib5fzJBdUcD |
|---|---|
| InChI | InChI=1S/C18H14O3/c1-14-7-10-16(11-8-14)17(19)13-21-18(20)12-9-15-5-3-2-4-6-15/h2-8,10-11H,13H2,1H3 |
| InChIKey | SHWRHYVVYXVHGK-UHFFFAOYSA-N |
| Mol Weight | 278.31 g/mol |
| Molecular Formula | C18H14O3 |
| Exact Mass | 278.094294 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | A1JvsAE7TXh |
|---|---|
| Name | 2-oxo-2-p-Tolylethyl 3-phenylpropiolate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 278.094294308 u |
| Formula | C18H14O3 |
| InChI | InChI=1S/C18H14O3/c1-14-7-10-16(11-8-14)17(19)13-21-18(20)12-9-15-5-3-2-4-6-15/h2-8,10-11H,13H2,1H3 |
| InChIKey | SHWRHYVVYXVHGK-UHFFFAOYSA-N |
| Molecular Weight | 278.307 g/mol |
| SMILES | C(C#CC=1C=CC=CC1)(=O)OCC(C=1C=CC(=CC1)C)=O |