![2,2,2-Trifluoro-N-[2-(4-nitro-phenyl)-ethyl]-acetamide](/api/spectrum/Dvef0XlBR72/structure.png?h=300&w=458 "2,2,2-Trifluoro-N-[2-(4-nitro-phenyl)-ethyl]-acetamide")
| SpectraBase Compound ID | GfNBEp0LJGG |
|---|---|
| InChI | InChI=1S/C10H9F3N2O3/c11-10(12,13)9(16)14-6-5-7-1-3-8(4-2-7)15(17)18/h1-4H,5-6H2,(H,14,16) |
| InChIKey | TXKHTPYMJBUBHQ-UHFFFAOYSA-N |
| Mol Weight | 262.19 g/mol |
| Molecular Formula | C10H9F3N2O3 |
| Exact Mass | 262.056527 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Dvef0XlBR72 |
|---|---|
| Name | 2,2,2-Trifluoro-N-[2-(4-nitro-phenyl)-ethyl]-acetamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 262.056526644 u |
| Formula | C10H9F3N2O3 |
| InChI | InChI=1S/C10H9F3N2O3/c11-10(12,13)9(16)14-6-5-7-1-3-8(4-2-7)15(17)18/h1-4H,5-6H2,(H,14,16) |
| InChIKey | TXKHTPYMJBUBHQ-UHFFFAOYSA-N |
| Molecular Weight | 262.188 g/mol |
| SMILES | C1=CC(CCNC(C(F)(F)F)=O)=CC=C1N(=O)=O |