SpectraBase Compound ID | ED9ueHcFzUM |
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InChI | InChI=1S/C10H13BrO2/c1-2-12-9-5-3-4-6-10(9)13-8-7-11/h3-6H,2,7-8H2,1H3 |
InChIKey | IOYHGBZPUZBUTJ-UHFFFAOYSA-N |
Mol Weight | 245.12 g/mol |
Molecular Formula | C10H13BrO2 |
Exact Mass | 244.009893 g/mol |
SpectraBase Spectrum ID | InhOH8Wkkd6 |
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Name | 1-(2-Bromoethoxy)-2-ethoxybenzene |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 244.009892657 u |
Formula | C10H13BrO2 |
InChI | InChI=1S/C10H13BrO2/c1-2-12-9-5-3-4-6-10(9)13-8-7-11/h3-6H,2,7-8H2,1H3 |
InChIKey | IOYHGBZPUZBUTJ-UHFFFAOYSA-N |
Molecular Weight | 245.116 g/mol |
SMILES | C(Br)COC1=C(C=CC=C1)OCC |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.885863 |