| SpectraBase Spectrum ID |
B0OkxUmhqg |
| Name |
2-(4-Chlorobenzylidene)-1,3-diphenylpropane-1,3-dione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
346.076057421 u |
| Formula |
C22H15ClO2 |
| InChI |
InChI=1S/C22H15ClO2/c23-19-13-11-16(12-14-19)15-20(21(24)17-7-3-1-4-8-17)22(25)18-9-5-2-6-10-18/h1-15H |
| InChIKey |
AHPVIBXXUMHCSE-UHFFFAOYSA-N |
| Molecular Weight |
346.813 g/mol |
| SMILES |
C=1C=C(C(C(C(C2=CC=CC=C2)=O)=CC2=CC=C(C=C2)Cl)=O)C=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.95156 |
