![2-Fluoro-1,4-bis[2-(4-fluorophenyl)ethynyl]benzene](/api/spectrum/5oyRD11GG9J/structure.png?h=300&w=458 "2-Fluoro-1,4-bis[2-(4-fluorophenyl)ethynyl]benzene")
| SpectraBase Compound ID | DZStOtmV9QD |
|---|---|
| InChI | InChI=1S/C22H11F3/c23-20-11-5-16(6-12-20)1-2-18-4-10-19(22(25)15-18)9-3-17-7-13-21(24)14-8-17/h4-8,10-15H |
| InChIKey | WNMNNFMOIBDWIE-UHFFFAOYSA-N |
| Mol Weight | 332.33 g/mol |
| Molecular Formula | C22H11F3 |
| Exact Mass | 332.081285 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5oyRD11GG9J |
|---|---|
| Name | 2-Fluoro-1,4-bis[2-(4-fluorophenyl)ethynyl]benzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 332.081284843 u |
| Formula | C22H11F3 |
| InChI | InChI=1S/C22H11F3/c23-20-11-5-16(6-12-20)1-2-18-4-10-19(22(25)15-18)9-3-17-7-13-21(24)14-8-17/h4-8,10-15H |
| InChIKey | WNMNNFMOIBDWIE-UHFFFAOYSA-N |
| Molecular Weight | 332.325 g/mol |
| SMILES | C(#CC1=CC=C(C=C1)F)C1=C(C=C(C#CC2=CC=C(C=C2)F)C=C1)F |