![3-[(2-CHLORO-6-FLUOROBENZYL)SULFONYL]-5-METHYL-4-ISOTHIAZOLECARBONITRILE](/api/spectrum/6esmgA7MzZU/structure.png?h=300&w=458 "3-[(2-CHLORO-6-FLUOROBENZYL)SULFONYL]-5-METHYL-4-ISOTHIAZOLECARBONITRILE")
| SpectraBase Compound ID | G7b7rnaFS1L |
|---|---|
| InChI | InChI=1S/C12H8ClFN2O2S2/c1-7-8(5-15)12(16-19-7)20(17,18)6-9-10(13)3-2-4-11(9)14/h2-4H,6H2,1H3 |
| InChIKey | BCEMJKFYFHBGJX-UHFFFAOYSA-N |
| Mol Weight | 330.78 g/mol |
| Molecular Formula | C12H8ClFN2O2S2 |
| Exact Mass | 329.969976 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | 6esmgA7MzZU |
|---|---|
| Name | 3-[(2-CHLORO-6-FLUOROBENZYL)SULFONYL]-5-METHYL-4-ISOTHIAZOLECARBONITRILE |
| Source of Sample | BIONET RESEARCH LTD., CORNWALL, ENGLAND |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H8ClFN2O2S2 |
| InChI | InChI=1S/C12H8ClFN2O2S2/c1-7-8(5-15)12(16-19-7)20(17,18)6-9-10(13)3-2-4-11(9)14/h2-4H,6H2,1H3 |
| InChIKey | BCEMJKFYFHBGJX-UHFFFAOYSA-N |
| Melting Point | 133-135C |
| Molecular Weight | 330.79 |
| Technique | KBr WAFER |