| SpectraBase Compound ID | 1L8qlJB8du2 |
|---|---|
| InChI | InChI=1S/C7H11BrO/c1-3-5-9-6-7(8)4-2/h3-4H,1,5-6H2,2H3/b7-4- |
| InChIKey | WITYIMPWUZJKAZ-DAXSKMNVSA-N |
| Mol Weight | 191.07 g/mol |
| Molecular Formula | C7H11BrO |
| Exact Mass | 189.999328 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 2JNx1aTbhbE |
|---|---|
| Name | (2-Bromo-2-buten-1-yl) (2'-propen-1'-yl) ether |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 189.999327973 u |
| Formula | C7H11BrO |
| InChI | InChI=1S/C7H11BrO/c1-3-5-9-6-7(8)4-2/h3-4H,1,5-6H2,2H3/b7-4- |
| InChIKey | WITYIMPWUZJKAZ-DAXSKMNVSA-N |
| Molecular Weight | 191.068 g/mol |
| SMILES | C\C=C\(Br)COCC=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.902966 |