1-(4-Ethoxyphenyl)-4-[3-(trifluoromethyl)phenyl]-4H-pyridine-3,5-dicarboxylic acid diethyl ester

SpectraBase Compound ID	7UpEZHg98R0
InChI	InChI=1S/C26H26F3NO5/c1-4-33-20-12-10-19(11-13-20)30-15-21(24(31)34-5-2)23(22(16-30)25(32)35-6-3)17-8-7-9-18(14-17)26(27,28)29/h7-16,23H,4-6H2,1-3H3
InChIKey	PPBBDBVGYVHRPU-UHFFFAOYSA-N Google Search
Mol Weight	489.49 g/mol
Molecular Formula	C26H26F3NO5
Exact Mass	489.176307 g/mol

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SpectraBase Spectrum ID	CpKN2ZausgJ
Name	3,5-pyridinedicarboxylic acid, 1-(4-ethoxyphenyl)-1,4-dihydro-4-[3-(trifluoromethyl)phenyl]-, diethyl 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	489.176307425 u
Formula	C26H26F3NO5
InChI	InChI=1S/C26H26F3NO5/c1-4-33-20-12-10-19(11-13-20)30-15-21(24(31)34-5-2)23(22(16-30)25(32)35-6-3)17-8-7-9-18(14-17)26(27,28)29/h7-16,23H,4-6H2,1-3H3
InChIKey	PPBBDBVGYVHRPU-UHFFFAOYSA-N
Molecular Weight	489.491 g/mol
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Sample State	Soluted
Sample_ID	1H_CB_2017_7410
Solvent	DMSO-d6
Source	Vendor ID: NMR/10230244; Lab Info: SAS; Lab Number: SAS-tst3477