| SpectraBase Compound ID | 7tcbcIZ37RQ |
|---|---|
| InChI | InChI=1S/C17H11FO3/c18-15-9-7-14(8-10-15)16(19)12-21-17(20)11-6-13-4-2-1-3-5-13/h1-5,7-10H,12H2 |
| InChIKey | MGALKMVWMPSPRW-UHFFFAOYSA-N |
| Mol Weight | 282.27 g/mol |
| Molecular Formula | C17H11FO3 |
| Exact Mass | 282.069222 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HAsRnnj9n03 |
|---|---|
| Name | 2-(4-Fluorophenyl)-2-oxoethyl 3-phenylpropiolate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 282.069222374 u |
| Formula | C17H11FO3 |
| InChI | InChI=1S/C17H11FO3/c18-15-9-7-14(8-10-15)16(19)12-21-17(20)11-6-13-4-2-1-3-5-13/h1-5,7-10H,12H2 |
| InChIKey | MGALKMVWMPSPRW-UHFFFAOYSA-N |
| Molecular Weight | 282.270 g/mol |
| SMILES | C(C#CC=1C=CC=CC1)(=O)OCC(=O)C=1C=CC(=CC1)F |