![3-[1-(Trifluoromethyl)-2,2,2-trifluoroethylidenehydrazono]-2-butanone](/api/spectrum/A1sJNxqWAen/structure.png?h=300&w=458 "3-[1-(Trifluoromethyl)-2,2,2-trifluoroethylidenehydrazono]-2-butanone")
| SpectraBase Compound ID | Iab0v5tj3jS |
|---|---|
| InChI | InChI=1S/C7H6F6N2O/c1-3(4(2)16)14-15-5(6(8,9)10)7(11,12)13/h1-2H3/b14-3- |
| InChIKey | FHVMHWGVDDUSFY-BNNQUZSASA-N |
| Mol Weight | 248.13 g/mol |
| Molecular Formula | C7H6F6N2O |
| Exact Mass | 248.038432 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | A1sJNxqWAen |
|---|---|
| Name | 3-[1-(Trifluoromethyl)-2,2,2-trifluoroethylidenehydrazono]-2-butanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 248.038431798 u |
| Formula | C7H6F6N2O |
| InChI | InChI=1S/C7H6F6N2O/c1-3(4(2)16)14-15-5(6(8,9)10)7(11,12)13/h1-2H3/b14-3- |
| InChIKey | FHVMHWGVDDUSFY-BNNQUZSASA-N |
| Molecular Weight | 248.128 g/mol |
| SMILES | C\C(=N\N=C(C(F)(F)F)C(F)(F)F)C(C)=O |