![3-[(m-CHLOROBENZYL)THIO]-5-METHYL-4-ISOTHIAZOLECARBONITRILE](/api/spectrum/AdqDnfK9Pcq/structure.png?h=300&w=458 "3-[(m-CHLOROBENZYL)THIO]-5-METHYL-4-ISOTHIAZOLECARBONITRILE")
| SpectraBase Compound ID | 14PW8Z1sMg5 |
|---|---|
| InChI | InChI=1S/C12H9ClN2S2/c1-8-11(6-14)12(15-17-8)16-7-9-3-2-4-10(13)5-9/h2-5H,7H2,1H3 |
| InChIKey | BDQGOHFFIGOPOZ-UHFFFAOYSA-N |
| Mol Weight | 280.79 g/mol |
| Molecular Formula | C12H9ClN2S2 |
| Exact Mass | 279.989568 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | AdqDnfK9Pcq |
|---|---|
| Name | 3-[(m-CHLOROBENZYL)THIO]-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 | C12H9ClN2S2 |
| InChI | InChI=1S/C12H9ClN2S2/c1-8-11(6-14)12(15-17-8)16-7-9-3-2-4-10(13)5-9/h2-5H,7H2,1H3 |
| InChIKey | BDQGOHFFIGOPOZ-UHFFFAOYSA-N |
| Melting Point | 75-77C |
| Molecular Weight | 280.80 |
| Technique | KBr WAFER |