| SpectraBase Compound ID | 9N0zjciSfGz |
|---|---|
| InChI | InChI=1S/C5H6BrNS/c1-4-2-5(3-6)8-7-4/h2H,3H2,1H3 |
| InChIKey | RRMLJJJCCPLURT-UHFFFAOYSA-N |
| Mol Weight | 192.07 g/mol |
| Molecular Formula | C5H6BrNS |
| Exact Mass | 190.940433 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1nANMxqKrd5 |
|---|---|
| Name | 5-Bromomethyl-3-methylisothiazole |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C5H6BrNS |
| InChI | InChI=1S/C5H6BrNS/c1-4-2-5(3-6)8-7-4/h2H,3H2,1H3 |
| InChIKey | RRMLJJJCCPLURT-UHFFFAOYSA-N |
| Molecular Weight | 192.074 g/mol |
| SMILES | c1(snc(c1)C)CBr |
| SPLASH | splash10-03di-0900000000-5f269c10ad0f0058c1d8 |
| Source of Spectrum | K-130-99-3 |
| Wiley ID | 1187249 |