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Ethyl 2-[(2-chlorobenzoyl)amino]-2-(3,4-dimethylanilino)-3,3,3-trifluoropropanoate
SpectraBase Compound ID 2YcugoyAoHp
InChI InChI=1S/C20H20ClF3N2O3/c1-4-29-18(28)19(20(22,23)24,25-14-10-9-12(2)13(3)11-14)26-17(27)15-7-5-6-8-16(15)21/h5-11,25H,4H2,1-3H3,(H,26,27)
InChIKey KBUAITFLMKBKHN-UHFFFAOYSA-N
Mol Weight 428.84 g/mol
Molecular Formula C20H20ClF3N2O3
Exact Mass 428.111455 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AoxTVsSEBs8
Name Ethyl 2-[(2-chlorobenzoyl)amino]-2-(3,4-dimethylanilino)-3,3,3-trifluoropropanoate
Alternate Name(s) 2-[(2-chlorobenzoyl)amino]-2-(3,4-dimethylanilino)-3,3,3-trifluoro-propionic acid ethyl ester 2-[[(2-chlorophenyl)-oxomethyl]amino]-2-(3,4-dimethylanilino)-3,3,3-trifluoropropanoic acid ethyl ester Ethyl 2-[(2-chlorophenyl)carbonylamino]-2-[(3,4-dimethylphenyl)amino]-3,3,3-tris(fluoranyl)propanoate Propanoic acid, 2-(2-chlorobenzoylamino)-3,3,3-trifluoro-2-(3,4-dimethylphenylamino)-, ethyl ester
CAS Registry Number 337469-53-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20ClF3N2O3
InChI InChI=1S/C20H20ClF3N2O3/c1-4-29-18(28)19(20(22,23)24,25-14-10-9-12(2)13(3)11-14)26-17(27)15-7-5-6-8-16(15)21/h5-11,25H,4H2,1-3H3,(H,26,27)
InChIKey KBUAITFLMKBKHN-UHFFFAOYSA-N
Molecular Weight 428.839 g/mol
SMILES N(C(C(F)(F)F)(C(=O)OCC)Nc1cc(C)c(cc1)C)C(c1c(Cl)cccc1)=O
SPLASH splash10-000i-1910000000-1b1aff622c18d1379819
Source of Spectrum AD-0-2532-0
Wiley ID 1431027