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5,7-Bis(4-chlorophenyl)-2-phenyl-4H-chromen-4-one
SpectraBase Compound ID 7LWrPQnQOYR
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
Mol Weight 443.33 g/mol
Molecular Formula C27H16Cl2O2
Exact Mass 442.052735 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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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