| SpectraBase Compound ID | 4yWxLp8dHyi |
|---|---|
| InChI | InChI=1S/C13H19BrO2/c1-11(2)7-8-15-9-10-16-13-5-3-12(14)4-6-13/h3-6,11H,7-10H2,1-2H3 |
| InChIKey | PWTLSQXGOGMHDT-UHFFFAOYSA-N |
| Mol Weight | 287.2 g/mol |
| Molecular Formula | C13H19BrO2 |
| Exact Mass | 286.056843 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | GS5A3SsalX2 |
|---|---|
| Name | 2-(4-Bromophenoxy)ethanol, 3-methylbutyl ether |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 286.056842850 u |
| Formula | C13H19BrO2 |
| InChI | InChI=1S/C13H19BrO2/c1-11(2)7-8-15-9-10-16-13-5-3-12(14)4-6-13/h3-6,11H,7-10H2,1-2H3 |
| InChIKey | PWTLSQXGOGMHDT-UHFFFAOYSA-N |
| SMILES | C1=C(C=CC(=C1)Br)OCCOCCC(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.901487 |