| SpectraBase Compound ID | CIaSP48lLrU |
|---|---|
| InChI | InChI=1S/C22H13F/c23-22-17-20(12-11-18-7-3-1-4-8-18)14-16-21(22)15-13-19-9-5-2-6-10-19/h1-10,14,16-17H |
| InChIKey | KEKGGMAMWSBWQH-UHFFFAOYSA-N |
| Mol Weight | 296.34 g/mol |
| Molecular Formula | C22H13F |
| Exact Mass | 296.100129 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8GXqqqDdmxp |
|---|---|
| Name | 2-Fluoro-1,4-bis(phenylethynyl)benzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 296.100128582 u |
| Formula | C22H13F |
| InChI | InChI=1S/C22H13F/c23-22-17-20(12-11-18-7-3-1-4-8-18)14-16-21(22)15-13-19-9-5-2-6-10-19/h1-10,14,16-17H |
| InChIKey | KEKGGMAMWSBWQH-UHFFFAOYSA-N |
| Molecular Weight | 296.344 g/mol |
| SMILES | C(#CC1=CC=CC=C1)C1=C(C=C(C#CC=2C=CC=CC2)C=C1)F |