N-(4-Ethylphenyl)-N'-[2-(4-fluorophenyl)ethyl]urea, N,N'-bis(trifluoroacetyl)-

SpectraBase Compound ID	1dMqvehdUq0
InChI	InChI=1S/C21H17F7N2O3/c1-2-13-5-9-16(10-6-13)30(18(32)21(26,27)28)19(33)29(17(31)20(23,24)25)12-11-14-3-7-15(22)8-4-14/h3-10H,2,11-12H2,1H3
InChIKey	PBDKPGAIWPLGLH-UHFFFAOYSA-N Google Search
Mol Weight	478.37 g/mol
Molecular Formula	C21H17F7N2O3
Exact Mass	478.11274 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	JEqmYZDVe9n
Name	N-(4-Ethylphenyl)-N'-[2-(4-fluorophenyl)ethyl]urea, N,N'-bis(trifluoroacetyl)-
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	478.112739553 u
Formula	C21H17F7N2O3
InChI	InChI=1S/C21H17F7N2O3/c1-2-13-5-9-16(10-6-13)30(18(32)21(26,27)28)19(33)29(17(31)20(23,24)25)12-11-14-3-7-15(22)8-4-14/h3-10H,2,11-12H2,1H3
InChIKey	PBDKPGAIWPLGLH-UHFFFAOYSA-N
Molecular Weight	478.367 g/mol
SMILES	C1(F)=CC=C(C=C1)CCN(C(=O)N(C1=CC=C(C=C1)CC)C(C(F)(F)F)=O)C(C(F)(F)F)=O
Spectrum/Structure Validation Score (Vapor Phase IR)	0.868237