| SpectraBase Compound ID | J77z9nQDBGM |
|---|---|
| InChI | InChI=1S/C6H9BrO2/c7-4-3-5-1-2-6(8)9-5/h5H,1-4H2/t5-/m1/s1 |
| InChIKey | GXYSKLOVHUBBFL-RXMQYKEDSA-N |
| Mol Weight | 193.04 g/mol |
| Molecular Formula | C6H9BrO2 |
| Exact Mass | 191.978593 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | EImNO9S5ePu |
|---|---|
| Name | (R)-Tetrahydro-5-oxo-2-(2-bromoethyl)furan |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 191.978592528 u |
| Formula | C6H9BrO2 |
| InChI | InChI=1S/C6H9BrO2/c7-4-3-5-1-2-6(8)9-5/h5H,1-4H2/t5-/m1/s1 |
| InChIKey | GXYSKLOVHUBBFL-RXMQYKEDSA-N |
| Molecular Weight | 193.040 g/mol |
| SMILES | C1(O[C@@](CCBr)(CC1)[H])=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.963361 |