| SpectraBase Compound ID | 48tKQltOQm0 |
|---|---|
| InChI | InChI=1S/C12H6F4/c1-3-5-7-8(6-4-2)10(14)12(16)11(15)9(7)13/h1-2H3 |
| InChIKey | JIFZVTCOHKFWBK-UHFFFAOYSA-N |
| Mol Weight | 226.17 g/mol |
| Molecular Formula | C12H6F4 |
| Exact Mass | 226.040563 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AHFHqAJ7VUS |
|---|---|
| Name | 1,2,3,4-Tetrafluoro-5,6-bis-(prop-1-ynyl)-benzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 226.040562845 u |
| Formula | C12H6F4 |
| InChI | InChI=1S/C12H6F4/c1-3-5-7-8(6-4-2)10(14)12(16)11(15)9(7)13/h1-2H3 |
| InChIKey | JIFZVTCOHKFWBK-UHFFFAOYSA-N |
| Molecular Weight | 226.174 g/mol |
| SMILES | C1(F)=C(F)C(F)=C(F)C(=C1C#CC)C#CC |