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Ethyl 2-(4-chloroanilino)-3,3,3-trifluoro-2-(2-phenylacetamido)propionate
SpectraBase Compound ID BOXrIo9s5MT
InChI InChI=1S/C19H18ClF3N2O3/c1-2-28-17(27)18(19(21,22)23,24-15-10-8-14(20)9-11-15)25-16(26)12-13-6-4-3-5-7-13/h3-11,24H,2,12H2,1H3,(H,25,26)
InChIKey LQKJQSCEFRTRLC-UHFFFAOYSA-N
Mol Weight 414.81 g/mol
Molecular Formula C19H18ClF3N2O3
Exact Mass 414.095805 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8jvnsNFDGn1
Name Ethyl 2-(4-chloroanilino)-3,3,3-trifluoro-2-(2-phenylacetamido)propionate
CAS Registry Number 256332-42-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18ClF3N2O3
InChI InChI=1S/C19H18ClF3N2O3/c1-2-28-17(27)18(19(21,22)23,24-15-10-8-14(20)9-11-15)25-16(26)12-13-6-4-3-5-7-13/h3-11,24H,2,12H2,1H3,(H,25,26)
InChIKey LQKJQSCEFRTRLC-UHFFFAOYSA-N
Molecular Weight 414.812 g/mol
SMILES N(C(Cc1ccccc1)=O)C(C(=O)OCC)(C(F)(F)F)Nc1ccc(cc1)Cl
SPLASH splash10-0006-9350000000-613ceff5edf5741d2563
Synonyms 2-(4-Chloroanilino)-3,3,3-trifluoro-2-[(1-oxo-2-phenylethyl)amino]propanoic acid ethyl ester 2-(4-Chloroanilino)-3,3,3-trifluoro-2-[(2-phenylacetyl)amino]propionic acid ethyl ester Ethyl 2-(4-chloroanilino)-3,3,3-trifluoro-2-[(2-phenylacetyl)amino]propanoate Ethyl 2-(4-chloroanilino)-3,3,3-trifluoro-2-[(phenylacetyl)amino]propanoate Ethyl 2-[(4-chlorophenyl)amino]-3,3,3-tris(fluoranyl)-2-(2-phenylethanoylamino)propanoate
Wiley ID 1467489