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1H-Pyrrole-2-carboxylic acid, 5,5'-(2,2,2-trichloroethylidene)bis[3,4-dimethyl-, diethyl ester
SpectraBase Compound ID K2KeeCUOme2
InChI InChI=1S/C20H25Cl3N2O4/c1-7-28-18(26)16-11(5)9(3)14(24-16)13(20(21,22)23)15-10(4)12(6)17(25-15)19(27)29-8-2/h13,24-25H,7-8H2,1-6H3
InChIKey LJLSBSUTFNDSEV-UHFFFAOYSA-N
Mol Weight 463.79 g/mol
Molecular Formula C20H25Cl3N2O4
Exact Mass 462.08799 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DsnGlH2yI7X
Name 1H-Pyrrole-2-carboxylic acid, 5,5'-(2,2,2-trichloroethylidene)bis[3,4-dimethyl-, diethyl ester
Alternate Name(s) 1,9-Dicarbethoxy-2,3,7,8-tetramethyl-5-trichlormethyl-5,10-dihydro-dipyrrin Ethyl 3,4-dimethyl-5-{2,2,2-trichloro-1-[5-(ethoxycarbonyl)-3,4-dimethyl-1H-pyrrol-2-yl]ethyl}-1H-pyrrole-2-carboxylate
CAS Registry Number 120456-27-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H25Cl3N2O4
InChI InChI=1S/C20H25Cl3N2O4/c1-7-28-18(26)16-11(5)9(3)14(24-16)13(20(21,22)23)15-10(4)12(6)17(25-15)19(27)29-8-2/h13,24-25H,7-8H2,1-6H3
InChIKey LJLSBSUTFNDSEV-UHFFFAOYSA-N
Molecular Weight 463.789 g/mol
SMILES [nH]1c(c(c(c1C(c1[nH]c(c(c1C)C)C(=O)OCC)C(Cl)(Cl)Cl)C)C)C(=O)OCC
SPLASH splash10-0005-0196100000-8b4470f604a6a461bad8
Source of Spectrum AH-119-1034-6
Wiley ID 1390928