Ethyl 1-cyclohexyl-4-[(cyclohexylcarbonyl)amino]-2-methyl-5-oxo-4-(trifluoromethyl)-4,5-dihydro-1H-pyrrole-3-carboxylate

SpectraBase Compound ID	5YWcr8LvkMN
InChI	InChI=1S/C22H31F3N2O4/c1-3-31-19(29)17-14(2)27(16-12-8-5-9-13-16)20(30)21(17,22(23,24)25)26-18(28)15-10-6-4-7-11-15/h15-16H,3-13H2,1-2H3,(H,26,28)
InChIKey	IWSNDXIYQKFCDZ-UHFFFAOYSA-N Google Search
Mol Weight	444.5 g/mol
Molecular Formula	C22H31F3N2O4
Exact Mass	444.223592 g/mol

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SpectraBase Spectrum ID	LdR3JlSJYGl
Name	1H-pyrrole-3-carboxylic acid, 1-cyclohexyl-4-[(cyclohexylcarbonyl)amino]-4,5-dihydro-2-methyl-5-oxo-4-(trifluoromethyl)-, ethyl ester
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C22H31F3N2O4/c1-3-31-19(29)17-14(2)27(16-12-8-5-9-13-16)20(30)21(17,22(23,24)25)26-18(28)15-10-6-4-7-11-15/h15-16H,3-13H2,1-2H3,(H,26,28)
InChIKey	IWSNDXIYQKFCDZ-UHFFFAOYSA-N
NMR Offset	17.9973
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB_8313_5913
Owner	Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State	soluted
Solvent	DMSO-d6
Source File Reference	VendorID: NMR/16231155; Labnumber: MRP-7693