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2-(cyclohexyliminomethylene)-3-(N-(2,2,2-trichloroacetyl)anilino)succinic acid dimethyl ester
SpectraBase Compound ID GoW56OkbqzE
InChI InChI=1S/C21H23Cl3N2O5/c1-30-18(27)16(13-25-14-9-5-3-6-10-14)17(19(28)31-2)26(20(29)21(22,23)24)15-11-7-4-8-12-15/h4,7-8,11-12,14,17H,3,5-6,9-10H2,1-2H3
InChIKey UGMYLOFUZPPFIN-UHFFFAOYSA-N
Mol Weight 489.78 g/mol
Molecular Formula C21H23Cl3N2O5
Exact Mass 488.067255 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6ZAWrH5WM9h
Name 2-(cyclohexyliminomethylene)-3-(N-(2,2,2-trichloroacetyl)anilino)succinic acid dimethyl ester
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Formula C21H23Cl3N2O5
InChI InChI=1S/C21H23Cl3N2O5/c1-30-18(27)16(13-25-14-9-5-3-6-10-14)17(19(28)31-2)26(20(29)21(22,23)24)15-11-7-4-8-12-15/h4,7-8,11-12,14,17H,3,5-6,9-10H2,1-2H3
InChIKey UGMYLOFUZPPFIN-UHFFFAOYSA-N
Molecular Weight 489.783 g/mol
SMILES C(C(N(C(C(Cl)(Cl)Cl)=O)c1ccccc1)C(=O)OC)(=C=NC1CCCCC1)C(=O)OC
SPLASH splash10-00g0-9660000000-5204973c4a8c6275eecc
Source of Spectrum G-69-1503-4
Synonyms 2-(cyclohexyliminomethylidene)-3-(N-(2,2,2-trichloro-1-oxoethyl)anilino)butanedioic acid dimethyl ester Dimethyl 2-(cyclohexyliminomethylene)-3-(N-(2,2,2-trichloroacetyl)anilino)butanedioate Dimethyl 2-(cyclohexyliminomethylidene)-3-(N-(2,2,2-trichloroacetyl)anilino)butanedioate Dimethyl 2-(cyclohexyliminomethylidene)-3-[phenyl-[2,2,2-tris(chloranyl)ethanoyl]amino]butanedioate
Wiley ID 1559671