SpectraBase Spectrum ID |
3yoZuagfDMM |
Name |
4-[(2-Bromophenyl)methoxy]-3-ethoxy-benzaldehyde |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
334.020457340 u |
Formula |
C16H15BrO3 |
InChI |
InChI=1S/C16H15BrO3/c1-2-19-16-9-12(10-18)7-8-15(16)20-11-13-5-3-4-6-14(13)17/h3-10H,2,11H2,1H3 |
InChIKey |
FWJFMBAJXRPHSG-UHFFFAOYSA-N |
Molecular Weight |
335.197 g/mol |
SMILES |
C1(=C(OCC2=C(Br)C=CC=C2)C=CC(=C1)C=O)OCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.898819 |