![3-[(o-CHLOROBENZYL)SULFONYL]-5-METHYL-4-ISOTHIAZOLECARBONITRILE](/api/spectrum/JJTeYEpJjHR/structure.png?h=300&w=458 "3-[(o-CHLOROBENZYL)SULFONYL]-5-METHYL-4-ISOTHIAZOLECARBONITRILE")
| SpectraBase Compound ID | B6EZ5QNq254 |
|---|---|
| InChI | InChI=1S/C12H9ClN2O2S2/c1-8-10(6-14)12(15-18-8)19(16,17)7-9-4-2-3-5-11(9)13/h2-5H,7H2,1H3 |
| InChIKey | DHNQMGHIZKQQOE-UHFFFAOYSA-N |
| Mol Weight | 312.79 g/mol |
| Molecular Formula | C12H9ClN2O2S2 |
| Exact Mass | 311.979398 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | JJTeYEpJjHR |
|---|---|
| Name | 3-[(o-CHLOROBENZYL)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 | C12H9ClN2O2S2 |
| InChI | InChI=1S/C12H9ClN2O2S2/c1-8-10(6-14)12(15-18-8)19(16,17)7-9-4-2-3-5-11(9)13/h2-5H,7H2,1H3 |
| InChIKey | DHNQMGHIZKQQOE-UHFFFAOYSA-N |
| Melting Point | 156-158C |
| Molecular Weight | 312.80 |
| Technique | KBr WAFER |