| SpectraBase Compound ID | 5uYBXxJxiKK |
|---|---|
| InChI | InChI=1S/C13H10Br2O/c1-16-9-6-7-11(13(15)8-9)10-4-2-3-5-12(10)14/h2-8H,1H3 |
| InChIKey | BGJXFVYYVHAQRV-UHFFFAOYSA-N |
| Mol Weight | 342.03 g/mol |
| Molecular Formula | C13H10Br2O |
| Exact Mass | 339.909841 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 9HUvUIGH8Mi |
|---|---|
| Name | 4-Methoxy-2,2'-dibromobiphenyl |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 339.909840941 u |
| Formula | C13H10Br2O |
| InChI | InChI=1S/C13H10Br2O/c1-16-9-6-7-11(13(15)8-9)10-4-2-3-5-12(10)14/h2-8H,1H3 |
| InChIKey | BGJXFVYYVHAQRV-UHFFFAOYSA-N |
| Molecular Weight | 342.030 g/mol |
| SMILES | C1(=C(C=C(C=C1)OC)Br)C1=C(Br)C=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.885889 |