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3,5-pyridinedicarboxylic acid, 1,4-dihydro-4-(3-nitrophenyl)-1-[3-(trifluoromethyl)phenyl]-, dimethyl ester
SpectraBase Compound ID uaiPhlohvO
InChI InChI=1S/C22H17F3N2O6/c1-32-20(28)17-11-26(15-7-4-6-14(10-15)22(23,24)25)12-18(21(29)33-2)19(17)13-5-3-8-16(9-13)27(30)31/h3-12,19H,1-2H3
InChIKey WOMHEXDNXFLSTM-UHFFFAOYSA-N
Mol Weight 462.38 g/mol
Molecular Formula C22H17F3N2O6
Exact Mass 462.103871 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JGX9AtzL2NF
Name 3,5-pyridinedicarboxylic acid, 1,4-dihydro-4-(3-nitrophenyl)-1-[3-(trifluoromethyl)phenyl]-, dimethyl 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/C22H17F3N2O6/c1-32-20(28)17-11-26(15-7-4-6-14(10-15)22(23,24)25)12-18(21(29)33-2)19(17)13-5-3-8-16(9-13)27(30)31/h3-12,19H,1-2H3
InChIKey WOMHEXDNXFLSTM-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_307
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/11221238; Labnumber: SAS-tst4571