| SpectraBase Compound ID | IJfEZKwNWoU |
|---|---|
| InChI | InChI=1S/C10H4F9NO/c11-8(12,13)4-1-5(9(14,15)16)3-6(2-4)20-7(21)10(17,18)19/h1-3H,(H,20,21) |
| InChIKey | WWCITLYURLCGKT-UHFFFAOYSA-N |
| Mol Weight | 325.13 g/mol |
| Molecular Formula | C10H4F9NO |
| Exact Mass | 325.014917 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JybVmy1gucA |
|---|---|
| Name | N-[3,5-bis(Trifluoromethyl)phenyl]-2,2,2-trifluoroacetamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 325.014917219 u |
| Formula | C10H4F9NO |
| InChI | InChI=1S/C10H4F9NO/c11-8(12,13)4-1-5(9(14,15)16)3-6(2-4)20-7(21)10(17,18)19/h1-3H,(H,20,21) |
| InChIKey | WWCITLYURLCGKT-UHFFFAOYSA-N |
| Molecular Weight | 325.134 g/mol |
| SMILES | C=1C(=CC(C(F)(F)F)=CC1C(F)(F)F)NC(=O)C(F)(F)F |