| SpectraBase Compound ID | 1nwvBFioui7 |
|---|---|
| InChI | InChI=1S/C8H17BrO2/c1-5-10-7(6-9)11-8(2,3)4/h7H,5-6H2,1-4H3 |
| InChIKey | GZFFSEAVFVMFQR-UHFFFAOYSA-N |
| Mol Weight | 225.13 g/mol |
| Molecular Formula | C8H17BrO2 |
| Exact Mass | 224.041193 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | BLNE2lA0E2W |
|---|---|
| Name | Propane, 2-(2-bromo-1-ethoxyethoxy)-2-methyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 224.041192785 u |
| Formula | C8H17BrO2 |
| InChI | InChI=1S/C8H17BrO2/c1-5-10-7(6-9)11-8(2,3)4/h7H,5-6H2,1-4H3 |
| InChIKey | GZFFSEAVFVMFQR-UHFFFAOYSA-N |
| Molecular Weight | 225.126 g/mol |
| SMILES | C(OC(OCC)CBr)(C)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.956426 |