| SpectraBase Compound ID | 7qpiT2m291B |
|---|---|
| InChI | InChI=1S/C12H11F7N2O/c1-21(2)8-5-3-7(4-6-8)20-9(22)10(13,14)11(15,16)12(17,18)19/h3-6H,1-2H3,(H,20,22) |
| InChIKey | SVGKNFNSCWLTCM-UHFFFAOYSA-N |
| Mol Weight | 332.22 g/mol |
| Molecular Formula | C12H11F7N2O |
| Exact Mass | 332.07596 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | D4EDPqWhH0z |
|---|---|
| Name | p-Phenylenediamine, N,N-dimethyl-N'-heptafluorobutyryl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 332.075960122 u |
| Formula | C12H11F7N2O |
| InChI | InChI=1S/C12H11F7N2O/c1-21(2)8-5-3-7(4-6-8)20-9(22)10(13,14)11(15,16)12(17,18)19/h3-6H,1-2H3,(H,20,22) |
| InChIKey | SVGKNFNSCWLTCM-UHFFFAOYSA-N |
| Molecular Weight | 332.222 g/mol |
| SMILES | C1=CC(=CC=C1NC(=O)C(C(C(F)(F)F)(F)F)(F)F)N(C)C |