| SpectraBase Spectrum ID |
Ac6KuCGvnlt |
| Name |
4-Bromo-1-chloro-2-(4-ethoxybenzyl)benzene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
323.991655770 u |
| Formula |
C15H14BrClO |
| InChI |
InChI=1S/C15H14BrClO/c1-2-18-14-6-3-11(4-7-14)9-12-10-13(16)5-8-15(12)17/h3-8,10H,2,9H2,1H3 |
| InChIKey |
ZUNCHZBITMUSRD-UHFFFAOYSA-N |
| Molecular Weight |
325.633 g/mol |
| SMILES |
C1(Br)=CC(=C(C=C1)Cl)CC1=CC=C(C=C1)OCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.854363 |