| SpectraBase Compound ID | C7IeI5CY7Ud |
|---|---|
| InChI | InChI=1S/C13H11BrO/c1-15-11-8-6-10(7-9-11)12-4-2-3-5-13(12)14/h2-9H,1H3 |
| InChIKey | VGIXLAHEQRRSOD-UHFFFAOYSA-N |
| Mol Weight | 263.13 g/mol |
| Molecular Formula | C13H11BrO |
| Exact Mass | 261.999328 g/mol |
| SpectraBase Spectrum ID | OePi9qv9l7 |
|---|---|
| Name | 2-Bromo-4'-methoxybiphenyl |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 261.999327973 u |
| Formula | C13H11BrO |
| InChI | InChI=1S/C13H11BrO/c1-15-11-8-6-10(7-9-11)12-4-2-3-5-13(12)14/h2-9H,1H3 |
| InChIKey | VGIXLAHEQRRSOD-UHFFFAOYSA-N |
| Molecular Weight | 263.134 g/mol |
| SMILES | C=1(Br)C=CC=CC1C1=CC=C(OC)C=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.886114 |