3,5-Dichloro-2-C-(3-methylbenzene)-1-N-[3-(trifluoromethyl)phenyl]benzene-1,2-diamido

SpectraBase Compound ID	1sRYIGTTOIW
InChI	InChI=1S/C22H15Cl2F3N2O2/c1-12-4-2-5-13(8-12)20(30)29-19-17(10-15(23)11-18(19)24)21(31)28-16-7-3-6-14(9-16)22(25,26)27/h2-11H,1H3,(H,28,31)(H,29,30)
InChIKey	AMWGBPYZRMHZNK-UHFFFAOYSA-N Google Search
Mol Weight	467.28 g/mol
Molecular Formula	C22H15Cl2F3N2O2
Exact Mass	466.046268 g/mol

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SpectraBase Spectrum ID	86L7Rmc0Rsg
Name	3,5-Dichloro-2-C-(3-methylbenzene)-1-N-[3-(trifluoromethyl)phenyl]benzene-1,2-diamido
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	466.046267618 u
Formula	C22H15Cl2F3N2O2
InChI	InChI=1S/C22H15Cl2F3N2O2/c1-12-4-2-5-13(8-12)20(30)29-19-17(10-15(23)11-18(19)24)21(31)28-16-7-3-6-14(9-16)22(25,26)27/h2-11H,1H3,(H,28,31)(H,29,30)
InChIKey	AMWGBPYZRMHZNK-UHFFFAOYSA-N
Molecular Weight	467.275 g/mol
SMILES	C1(=C(NC(C=2C=C(C)C=CC2)=O)C(Cl)=CC(=C1)Cl)C(NC1=CC(C(F)(F)F)=CC=C1)=O
Spectrum/Structure Validation Score (Vapor Phase IR)	0.909474