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1H-Pyrrole-3-carboxylic acid, 1-butyl-4-[(2,4-dichlorobenzoyl)amino]-4,5-dihydro-2-methyl-5-oxo-4-(trifluoromethyl)-, methyl ester

View entire compound with spectra: 1 MS (GC)

1H-Pyrrole-3-carboxylic acid, 1-butyl-4-[(2,4-dichlorobenzoyl)amino]-4,5-dihydro-2-methyl-5-oxo-4-(trifluoromethyl)-, methyl ester
SpectraBase Compound ID CICzw8zYmRr
InChI InChI=1S/C19H19Cl2F3N2O4/c1-4-5-8-26-10(2)14(16(28)30-3)18(17(26)29,19(22,23)24)25-15(27)12-7-6-11(20)9-13(12)21/h6-7,9H,4-5,8H2,1-3H3,(H,25,27)
InChIKey FCRNOMAEDDZJNS-UHFFFAOYSA-N
Mol Weight 467.27 g/mol
Molecular Formula C19H19Cl2F3N2O4
Exact Mass 466.067397 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2O1RXXaeBI3
Name 1H-Pyrrole-3-carboxylic acid, 1-butyl-4-[(2,4-dichlorobenzoyl)amino]-4,5-dihydro-2-methyl-5-oxo-4-(trifluoromethyl)-, methyl ester
Alternate Name(s) Methyl 1-butyl-4-[(2,4-dichlorobenzene)amido]-2-methyl-5-oxo-4-(trifluoromethyl)-4,5-dihydro-1H-pyrrole-3-carboxylate 1-Butyl-4-[[(2,4-dichlorophenyl)-oxomethyl]amino]-2-methyl-5-oxo-4-(trifluoromethyl)-3-pyrrolecarboxylic acid methyl ester Methyl 1-butyl-4-[(2,4-dichlorobenzoyl)amino]-2-methyl-5-oxo-4-(trifluoromethyl)pyrrole-3-carboxylate Methyl 1-butyl-4-[(2,4-dichlorophenyl)carbonylamino]-2-methyl-5-oxidanylidene-4-(trifluoromethyl)pyrrole-3-carboxylate
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Formula C19H19Cl2F3N2O4
InChI InChI=1S/C19H19Cl2F3N2O4/c1-4-5-8-26-10(2)14(16(28)30-3)18(17(26)29,19(22,23)24)25-15(27)12-7-6-11(20)9-13(12)21/h6-7,9H,4-5,8H2,1-3H3,(H,25,27)
InChIKey FCRNOMAEDDZJNS-UHFFFAOYSA-N
Molecular Weight 467.272 g/mol
SMILES N(C1(C(N(C(=C1C(=O)OC)C)CCCC)=O)C(F)(F)F)C(=O)c1c(cc(cc1)Cl)Cl
SPLASH splash10-00fr-2900000000-a37dc764898c33c67e36
Source of Spectrum IY-2-5051-5
Wiley ID 1658498