| SpectraBase Compound ID | CPVeT9wxyHv |
|---|---|
| InChI | InChI=1S/C12H6F6N2O2/c13-11(14,15)5-21-9-1-2-10(22-6-12(16,17)18)8(4-20)7(9)3-19/h1-2H,5-6H2 |
| InChIKey | CORWMYGMHAJLEO-UHFFFAOYSA-N |
| Mol Weight | 324.18 g/mol |
| Molecular Formula | C12H6F6N2O2 |
| Exact Mass | 324.033346 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HlWZW4c7Syq |
|---|---|
| Name | 1,2-Dicyano-3,6-bis(2,2,2-trifluoroethoxy)benzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 324.033346417 u |
| Formula | C12H6F6N2O2 |
| InChI | InChI=1S/C12H6F6N2O2/c13-11(14,15)5-21-9-1-2-10(22-6-12(16,17)18)8(4-20)7(9)3-19/h1-2H,5-6H2 |
| InChIKey | CORWMYGMHAJLEO-UHFFFAOYSA-N |
| Molecular Weight | 324.182 g/mol |
| SMILES | C=1(C(C#N)=C(OCC(F)(F)F)C=CC1OCC(F)(F)F)C#N |