1-[4-nitro-2-[oxo-[4-(trifluoromethoxy)anilino]methyl]phenyl]-4-piperidinecarboxylic acid ethyl ester

SpectraBase Compound ID	GJHK29vRJL0
InChI	InChI=1S/C22H22F3N3O6/c1-2-33-21(30)14-9-11-27(12-10-14)19-8-5-16(28(31)32)13-18(19)20(29)26-15-3-6-17(7-4-15)34-22(23,24)25/h3-8,13-14H,2,9-12H2,1H3,(H,26,29)
InChIKey	AKWVYSQQUQMMCZ-UHFFFAOYSA-N Google Search
Mol Weight	481.43 g/mol
Molecular Formula	C22H22F3N3O6
Exact Mass	481.14607 g/mol

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SpectraBase Spectrum ID	Bcg6TVxXzdt
Name	4-piperidinecarboxylic acid, 1-[4-nitro-2-[[[4-(trifluoromethoxy)phenyl]amino]carbonyl]phenyl]-, ethyl ester
Copyright	Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	481.146069923 u
Formula	C22H22F3N3O6
InChI	InChI=1S/C22H22F3N3O6/c1-2-33-21(30)14-9-11-27(12-10-14)19-8-5-16(28(31)32)13-18(19)20(29)26-15-3-6-17(7-4-15)34-22(23,24)25/h3-8,13-14H,2,9-12H2,1H3,(H,26,29)
InChIKey	AKWVYSQQUQMMCZ-UHFFFAOYSA-N
Molecular Weight	481.428 g/mol
NMR Offset	16.0087
NMR Spectrometer Frequency	500.133
Observed nucleus	1H
Sample State	Soluted
Sample_ID	1H_CB_2017_5182
Solvent	DMSO-d6
Source	Vendor ID: NMR/9300109; Lab Info: DS; Lab Number: DS-0000001