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4-(3,4-dichlorophenyl)-1-(1-phenylethyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester

View entire compound with spectra: 1 NMR, and 1 MS (GC)

4-(3,4-dichlorophenyl)-1-(1-phenylethyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester
SpectraBase Compound ID 89NWiXlwYHY
InChI InChI=1S/C23H21Cl2NO4/c1-14(15-7-5-4-6-8-15)26-12-17(22(27)29-2)21(18(13-26)23(28)30-3)16-9-10-19(24)20(25)11-16/h4-14,21H,1-3H3
InChIKey KMEGCWHLXQRZEU-UHFFFAOYSA-N
Mol Weight 446.33 g/mol
Molecular Formula C23H21Cl2NO4
Exact Mass 445.084764 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DfeToIKIUy6
Name 3,5-pyridinedicarboxylic acid, 4-(3,4-dichlorophenyl)-1,4-dihydro-1-(1-phenylethyl)-, dimethyl 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 445.084763556 u
Formula C23H21Cl2NO4
InChI InChI=1S/C23H21Cl2NO4/c1-14(15-7-5-4-6-8-15)26-12-17(22(27)29-2)21(18(13-26)23(28)30-3)16-9-10-19(24)20(25)11-16/h4-14,21H,1-3H3
InChIKey KMEGCWHLXQRZEU-UHFFFAOYSA-N
Molecular Weight 446.330 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_11354
Solvent DMSO-d6
Source Vendor ID: NMR/10261345; Lab Info: SAS; Lab Number: SAS-tst3922
Temperature 29.85 °C