SpectraBase Spectrum ID |
62Zh7i3NtkQ |
Name |
5,7-bis(4-Chlorophenyl)-2-phenyl-4H-chromen-4-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
442.052735153 u |
Formula |
C27H16Cl2O2 |
InChI |
InChI=1S/C27H16Cl2O2/c28-21-10-6-17(7-11-21)20-14-23(18-8-12-22(29)13-9-18)27-24(30)16-25(31-26(27)15-20)19-4-2-1-3-5-19/h1-16H |
InChIKey |
UZUDDMXTEQAAIF-UHFFFAOYSA-N |
Molecular Weight |
443.329 g/mol |
SMILES |
C=12C(C=C(OC2=CC(C2=CC=C(C=C2)Cl)=CC1C=1C=CC(=CC1)Cl)C=1C=CC=CC1)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.908461 |