| SpectraBase Compound ID | FIxLdSQfMbH |
|---|---|
| InChI | InChI=1S/C6H11BrO/c7-4-2-1-3-6-5-8-6/h6H,1-5H2/t6-/m0/s1 |
| InChIKey | DDDKRQUCUNMSDF-LURJTMIESA-N |
| Mol Weight | 179.06 g/mol |
| Molecular Formula | C6H11BrO |
| Exact Mass | 177.999328 g/mol |
| SpectraBase Spectrum ID | 5bQ5SUjnTsu |
|---|---|
| Name | (S)-6-Bromo-1,2-epoxyhexane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 177.999327973 u |
| Formula | C6H11BrO |
| InChI | InChI=1S/C6H11BrO/c7-4-2-1-3-6-5-8-6/h6H,1-5H2/t6-/m0/s1 |
| InChIKey | DDDKRQUCUNMSDF-LURJTMIESA-N |
| Molecular Weight | 179.057 g/mol |
| SMILES | C1[C@](CCCCBr)(O1)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.939651 |