| SpectraBase Compound ID | 1rPSeELxni |
|---|---|
| InChI | InChI=1S/C7H5Cl3O2S/c1-13(11,12)7-3-5(9)4(8)2-6(7)10/h2-3H,1H3 |
| InChIKey | BLRLBBXZXPUHIH-UHFFFAOYSA-N |
| Mol Weight | 259.53 g/mol |
| Molecular Formula | C7H5Cl3O2S |
| Exact Mass | 257.907584 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8mw8PifXy8w |
|---|---|
| Name | 1,2,4-Trichloro-5-(methylsulfonyl)benzene |
| Alternate Name(s) | 1,2,4-trichloro-5-mesyl-benzene 1,2,4-tris(chloranyl)-5-methylsulfonyl-benzene 2,4,5-Trichlorophenyl methyl sulfone Benzene, 1,2,4-trichloro-5-(methylsulfonyl)- Methyl 2,4,5-trichlorophenyl sulfone Sulfone, methyl 2,4,5-trichlorophenyl 1,2,4-trichloro-5-methylsulfonylbenzene |
| CAS Registry Number | 4163-80-8 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H5Cl3O2S |
| InChI | InChI=1S/C7H5Cl3O2S/c1-13(11,12)7-3-5(9)4(8)2-6(7)10/h2-3H,1H3 |
| InChIKey | BLRLBBXZXPUHIH-UHFFFAOYSA-N |
| Molecular Weight | 259.534 g/mol |
| SMILES | CS(c1cc(c(cc1Cl)Cl)Cl)(=O)=O |
| SPLASH | splash10-0002-0940000000-1b7a63b480b1fddabbcd |
| Source of Spectrum | TE-1992-1519-0 |
| Wiley ID | 1261126 |