| SpectraBase Compound ID | 2nfyA34uApe |
|---|---|
| InChI | InChI=1S/C4HBrN2S/c5-4-3(1-6)2-8-7-4/h2H |
| InChIKey | FMZAFRSEAKSCQY-UHFFFAOYSA-N |
| Mol Weight | 189.03 g/mol |
| Molecular Formula | C4HBrN2S |
| Exact Mass | 187.904382 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DcUPItcySpB |
|---|---|
| Name | 3-Bromoisothiazole-4-carbonitrile |
| Alternate Name(s) | 3-Bromo-4-isothiazolecarbonitrile 3-Bromo-1,2-thiazole-4-carbonitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C4HBrN2S |
| InChI | InChI=1S/C4HBrN2S/c5-4-3(1-6)2-8-7-4/h2H |
| InChIKey | FMZAFRSEAKSCQY-UHFFFAOYSA-N |
| Molecular Weight | 189.030 g/mol |
| SMILES | c1(c(nsc1)Br)C#N |
| SPLASH | splash10-001c-4900000000-25cdcdd69d35bafa05a1 |
| Source of Spectrum | F-67-3352-3 |
| Wiley ID | 1686496 |