![Methyl-[4-(2,3,4,5,6-pentafluorophenyl)phenyl]amine](/api/spectrum/DbllQ1CSyMr/structure.png?h=300&w=458 "Methyl-[4-(2,3,4,5,6-pentafluorophenyl)phenyl]amine")
| SpectraBase Compound ID | GpQlV7pgZhm |
|---|---|
| InChI | InChI=1S/C13H8F5N/c1-19-7-4-2-6(3-5-7)8-9(14)11(16)13(18)12(17)10(8)15/h2-5,19H,1H3 |
| InChIKey | BGBHCFBUWXHZBA-UHFFFAOYSA-N |
| Mol Weight | 273.21 g/mol |
| Molecular Formula | C13H8F5N |
| Exact Mass | 273.05769 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DbllQ1CSyMr |
|---|---|
| Name | Methyl-[4-(2,3,4,5,6-pentafluorophenyl)phenyl]amine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 273.057690077 u |
| Formula | C13H8F5N |
| InChI | InChI=1S/C13H8F5N/c1-19-7-4-2-6(3-5-7)8-9(14)11(16)13(18)12(17)10(8)15/h2-5,19H,1H3 |
| InChIKey | BGBHCFBUWXHZBA-UHFFFAOYSA-N |
| Molecular Weight | 273.206 g/mol |
| SMILES | C=1(C(=C(F)C(=C(C1F)F)F)F)C1=CC=C(C=C1)NC |