| SpectraBase Compound ID | 8hLwrfWwkPb |
|---|---|
| InChI | InChI=1S/C9H7F3N2O3/c1-5-6(13-8(15)9(10,11)12)3-2-4-7(5)14(16)17/h2-4H,1H3,(H,13,15) |
| InChIKey | YCFQKHLDFAJDDT-UHFFFAOYSA-N |
| Mol Weight | 248.16 g/mol |
| Molecular Formula | C9H7F3N2O3 |
| Exact Mass | 248.040877 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | C0eJJiYh6fq |
|---|---|
| Name | 2,2,2-Tris(fluoranyl)-N-(2-methyl-3-nitro-phenyl)ethanamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 248.040876579 u |
| Formula | C9H7F3N2O3 |
| InChI | InChI=1S/C9H7F3N2O3/c1-5-6(13-8(15)9(10,11)12)3-2-4-7(5)14(16)17/h2-4H,1H3,(H,13,15) |
| InChIKey | YCFQKHLDFAJDDT-UHFFFAOYSA-N |
| Molecular Weight | 248.161 g/mol |
| SMILES | C=1(C(=C(C=CC1)N(=O)=O)C)NC(C(F)(F)F)=O |