| SpectraBase Compound ID | H5891d7EIO |
|---|---|
| InChI | InChI=1S/C12H6BrCl2F2NO2S/c13-8-3-6(16)4-11(17)12(8)18-21(19,20)7-1-2-9(14)10(15)5-7/h1-5,18H |
| InChIKey | NNKLQNNNBJNEAI-UHFFFAOYSA-N |
| Mol Weight | 417.05 g/mol |
| Molecular Formula | C12H6BrCl2F2NO2S |
| Exact Mass | 414.864774 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GNwTbfs2Gdb |
|---|---|
| Name | 2'-Bromo-3,4-dichloro-4',6'-difluorobenzenesulfonanilide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 414.864774335 u |
| Formula | C12H6BrCl2F2NO2S |
| InChI | InChI=1S/C12H6BrCl2F2NO2S/c13-8-3-6(16)4-11(17)12(8)18-21(19,20)7-1-2-9(14)10(15)5-7/h1-5,18H |
| InChIKey | NNKLQNNNBJNEAI-UHFFFAOYSA-N |
| Molecular Weight | 417.052 g/mol |
| SMILES | N(S(C1=CC=C(C(=C1)Cl)Cl)(=O)=O)C=1C(=CC(=CC1F)F)Br |