| SpectraBase Compound ID | HKhdb7vZBJR |
|---|---|
| InChI | InChI=1S/C8H8F3NO2S/c1-15(13,14)12-7-4-2-6(3-5-7)8(9,10)11/h2-5,12H,1H3 |
| InChIKey | QAMPCHWLFPGVCG-UHFFFAOYSA-N |
| Mol Weight | 239.21 g/mol |
| Molecular Formula | C8H8F3NO2S |
| Exact Mass | 239.022784 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5q80wlN5EUB |
|---|---|
| Name | Phenylamine, 4-trifluoromethyl-N-methylsulfonyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 239.022784163 u |
| Formula | C8H8F3NO2S |
| InChI | InChI=1S/C8H8F3NO2S/c1-15(13,14)12-7-4-2-6(3-5-7)8(9,10)11/h2-5,12H,1H3 |
| InChIKey | QAMPCHWLFPGVCG-UHFFFAOYSA-N |
| Molecular Weight | 239.212 g/mol |
| SMILES | C1=CC(=CC=C1NS(=O)(=O)C)C(F)(F)F |