| SpectraBase Compound ID | ExwnetvjLN1 |
|---|---|
| InChI | InChI=1S/C6H5Br2NO/c1-9-2-4(7)6(10)5(8)3-9/h2-3H,1H3 |
| InChIKey | LYSNTLIRWAIQGH-UHFFFAOYSA-N |
| Mol Weight | 266.92 g/mol |
| Molecular Formula | C6H5Br2NO |
| Exact Mass | 264.87379 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | LpfRdLyAyBL |
|---|---|
| Name | 3,5-Dibromo-1-methyl-4(1H)-pyridone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 264.873789784 u |
| Formula | C6H5Br2NO |
| InChI | InChI=1S/C6H5Br2NO/c1-9-2-4(7)6(10)5(8)3-9/h2-3H,1H3 |
| InChIKey | LYSNTLIRWAIQGH-UHFFFAOYSA-N |
| SMILES | C1(=O)C(Br)=CN(C=C1Br)C |
| Spectrum/Structure Validation Score (Raman) | 0.903547 |