1-benzyl-2-[3,5-bis(trifluoromethyl)benzamido]-4,5-dimethylpyrrole-3-carboxylic acid, ethyl ester

SpectraBase Compound ID	JcTgmi5nEad
InChI	InChI=1S/C25H22F6N2O3/c1-4-36-23(35)20-14(2)15(3)33(13-16-8-6-5-7-9-16)21(20)32-22(34)17-10-18(24(26,27)28)12-19(11-17)25(29,30)31/h5-12H,4,13H2,1-3H3,(H,32,34)
InChIKey	KQBURBCIDAEBMS-UHFFFAOYSA-N Google Search
Mol Weight	512.45 g/mol
Molecular Formula	C25H22F6N2O3
Exact Mass	512.153462 g/mol

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SpectraBase Spectrum ID	1vgZox98XRw
Name	1-BENZYL-2-[3,5-BIS(TRIFLUOROMETHYL)BENZAMIDO]-4,5-DIMETHYLPYRROLE-3-CARBOXYLIC ACID, ETHYL ESTER
Source of Sample	Maybridge Chemical Company Ltd., North Cornwall, England
Copyright	Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C25H22F6N2O3
InChI	InChI=1S/C25H22F6N2O3/c1-4-36-23(35)20-14(2)15(3)33(13-16-8-6-5-7-9-16)21(20)32-22(34)17-10-18(24(26,27)28)12-19(11-17)25(29,30)31/h5-12H,4,13H2,1-3H3,(H,32,34)
InChIKey	KQBURBCIDAEBMS-UHFFFAOYSA-N
Melting Point	180-182C
Molecular Weight	512.46
Solvent	Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300
Synonyms	PYRROLE-3-CARBOXYLIC ACID, 1-BENZYL-2-[3,5-BIS(TRIFLUOROMETHYL)BENZAMIDO]-4,5-DIMETHYL-, ETHYL ESTER