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3,5-pyridinedicarboxylic acid, 1-(3,5-dimethylphenyl)-1,4-dihydro-4-[3-(trifluoromethyl)phenyl]-, diethyl ester
SpectraBase Compound ID 38s06Hg07QT
InChI InChI=1S/C26H26F3NO4/c1-5-33-24(31)21-14-30(20-11-16(3)10-17(4)12-20)15-22(25(32)34-6-2)23(21)18-8-7-9-19(13-18)26(27,28)29/h7-15,23H,5-6H2,1-4H3
InChIKey NGUHQVFMYYDSGC-UHFFFAOYSA-N
Mol Weight 473.49 g/mol
Molecular Formula C26H26F3NO4
Exact Mass 473.181393 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CpcgEo05TQH
Name 3,5-pyridinedicarboxylic acid, 1-(3,5-dimethylphenyl)-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 473.181392806 u
Formula C26H26F3NO4
InChI InChI=1S/C26H26F3NO4/c1-5-33-24(31)21-14-30(20-11-16(3)10-17(4)12-20)15-22(25(32)34-6-2)23(21)18-8-7-9-19(13-18)26(27,28)29/h7-15,23H,5-6H2,1-4H3
InChIKey NGUHQVFMYYDSGC-UHFFFAOYSA-N
Molecular Weight 473.492 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_9373
Solvent DMSO-d6
Source Vendor ID: NMR/10240527; Lab Info: SAS; Lab Number: SAS-tst3715
Temperature 23.85 °C