| SpectraBase Compound ID | 9eeVgSbxqWT |
|---|---|
| InChI | InChI=1S/C4BrClN2S/c5-4-3(6)2(1-7)9-8-4 |
| InChIKey | PHCYLHRWWKYCMR-UHFFFAOYSA-N |
| Mol Weight | 223.47 g/mol |
| Molecular Formula | C4BrClN2S |
| Exact Mass | 221.86541 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BqnyyhRBrG7 |
|---|---|
| Name | 3-Bromo-4-chloroisothiazole-5-carbonitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C4BrClN2S |
| InChI | InChI=1S/C4BrClN2S/c5-4-3(6)2(1-7)9-8-4 |
| InChIKey | PHCYLHRWWKYCMR-UHFFFAOYSA-N |
| Literature Reference DOI | 10.1039/c3ra47261b |
| Molecular Weight | 223.475 g/mol |
| SMILES | c1(c(c(Br)ns1)Cl)C#N |
| SPLASH | splash10-00xr-1980000000-81a08ccf75aaedbc7b48 |
| Source of Spectrum | RSA-4-7745-27b |
| Wiley ID | 1747913 |