![2-Nitro-N-[3',5'-bis(trifluoromethyl)]phenylaniline](/api/spectrum/EuIaYVyxrOP/structure.png?h=300&w=458 "2-Nitro-N-[3',5'-bis(trifluoromethyl)]phenylaniline")
| SpectraBase Compound ID | BAAJkVxFHG1 |
|---|---|
| InChI | InChI=1S/C14H8F6N2O2/c15-13(16,17)8-5-9(14(18,19)20)7-10(6-8)21-11-3-1-2-4-12(11)22(23)24/h1-7,21H |
| InChIKey | QJDIGSKRSZDCAA-UHFFFAOYSA-N |
| Mol Weight | 350.22 g/mol |
| Molecular Formula | C14H8F6N2O2 |
| Exact Mass | 350.048996 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EuIaYVyxrOP |
|---|---|
| Name | 2-Nitro-N-[3',5'-bis(trifluoromethyl)]phenylaniline |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 350.048996482 u |
| Formula | C14H8F6N2O2 |
| InChI | InChI=1S/C14H8F6N2O2/c15-13(16,17)8-5-9(14(18,19)20)7-10(6-8)21-11-3-1-2-4-12(11)22(23)24/h1-7,21H |
| InChIKey | QJDIGSKRSZDCAA-UHFFFAOYSA-N |
| Molecular Weight | 350.220 g/mol |
| SMILES | C=1(N(=O)=O)C(NC2=CC(C(F)(F)F)=CC(C(F)(F)F)=C2)=CC=CC1 |