SpectraBase Spectrum ID |
FGbLxtjVeq6 |
Name |
1-(4-Chlorophenylmethylene)indene-3-carbaldehyde |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
266.049842673 u |
Formula |
C17H11ClO |
InChI |
InChI=1S/C17H11ClO/c18-15-7-5-12(6-8-15)9-13-10-14(11-19)17-4-2-1-3-16(13)17/h1-11H/b13-9+ |
InChIKey |
MGAVIRSHBZPGAQ-UKTHLTGXSA-N |
SMILES |
C=1\C(C2=C(C1C=O)C=CC=C2)=C/C1=CC=C(Cl)C=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.946031 |