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N-(2,2-diphenylethyl)-N'-[3-(trifluoromethyl)phenyl]urea
SpectraBase Compound ID J0ps6VFECi8
InChI InChI=1S/C22H19F3N2O/c23-22(24,25)18-12-7-13-19(14-18)27-21(28)26-15-20(16-8-3-1-4-9-16)17-10-5-2-6-11-17/h1-14,20H,15H2,(H2,26,27,28)
InChIKey UPNMPIDBZUTESX-UHFFFAOYSA-N
Mol Weight 384.4 g/mol
Molecular Formula C22H19F3N2O
Exact Mass 384.144948 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID CFfYv5hgewm
Name N-(2,2-Diphenylethyl)-N'-[3-(trifluoromethyl)phenyl]urea
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 384.144947728 u
Formula C22H19F3N2O
InChI InChI=1S/C22H19F3N2O/c23-22(24,25)18-12-7-13-19(14-18)27-21(28)26-15-20(16-8-3-1-4-9-16)17-10-5-2-6-11-17/h1-14,20H,15H2,(H2,26,27,28)
InChIKey UPNMPIDBZUTESX-UHFFFAOYSA-N
Molecular Weight 384.402 g/mol
SMILES C(C=1C=C(NC(NCC(C=2C=CC=CC2)C2=CC=CC=C2)=O)C=CC1)(F)(F)F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.918716