| SpectraBase Compound ID | Hhk7IPQBRHj |
|---|---|
| InChI | InChI=1S/C4HBrN2S/c5-4-3(1-6)2-8-7-4/h2H/i2D |
| InChIKey | FMZAFRSEAKSCQY-VMNATFBRSA-N |
| Mol Weight | 190.04 g/mol |
| Molecular Formula | C42DBrN2S |
| Exact Mass | 188.910659 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4h0fyi9IGnT |
|---|---|
| Name | 3-Bromo-5-deuterioisothiazole-4-carbonitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C4DBrN2S |
| InChI | InChI=1S/C4HBrN2S/c5-4-3(1-6)2-8-7-4/h2H/i2D |
| InChIKey | FMZAFRSEAKSCQY-VMNATFBRSA-N |
| Molecular Weight | 190.036 g/mol |
| SMILES | c1(c(nsc1[2D])Br)C#N |
| SPLASH | splash10-001u-9800000000-191a3dacb9e617a59191 |
| Source of Spectrum | F-67-3352-10 |
| Wiley ID | 1686494 |