| SpectraBase Compound ID | FShZThvZfit |
|---|---|
| InChI | InChI=1S/C5H9BrO3/c1-4(7)3-9-5(8)2-6/h4,7H,2-3H2,1H3 |
| InChIKey | YLKMTQHJTPXQOL-UHFFFAOYSA-N |
| Mol Weight | 197.03 g/mol |
| Molecular Formula | C5H9BrO3 |
| Exact Mass | 195.973507 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 4HuqOKTzoZw |
|---|---|
| Name | Nalcon 240 |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 195.973507147 u |
| Formula | C5H9BrO3 |
| InChI | InChI=1S/C5H9BrO3/c1-4(7)3-9-5(8)2-6/h4,7H,2-3H2,1H3 |
| InChIKey | YLKMTQHJTPXQOL-UHFFFAOYSA-N |
| SMILES | OC(COC(CBr)=O)C |
| Spectrum/Structure Validation Score (Raman) | 0.84891 |