SpectraBase Spectrum ID |
H5bor5xJf2q |
Name |
Benzaldehyde, 4-(3-chlorobenzyloxy)-3-ethoxy- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
290.070972040 u |
Formula |
C16H15ClO3 |
InChI |
InChI=1S/C16H15ClO3/c1-2-19-16-9-12(10-18)6-7-15(16)20-11-13-4-3-5-14(17)8-13/h3-10H,2,11H2,1H3 |
InChIKey |
JFXPCJXNQRPGSI-UHFFFAOYSA-N |
SMILES |
C1(=C(OCC2=CC(Cl)=CC=C2)C=CC(=C1)C=O)OCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.91642 |