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3,5-pyridinedicarboxylic acid, 4-(1,3-benzodioxol-5-yl)-1-(3,5-dimethylphenyl)-1,4-dihydro-, diethyl ester
SpectraBase Compound ID ANwZvp4ZKF3
InChI InChI=1S/C26H27NO6/c1-5-30-25(28)20-13-27(19-10-16(3)9-17(4)11-19)14-21(26(29)31-6-2)24(20)18-7-8-22-23(12-18)33-15-32-22/h7-14,24H,5-6,15H2,1-4H3
InChIKey ZRDSQYPMLWJCAF-UHFFFAOYSA-N
Mol Weight 449.5 g/mol
Molecular Formula C26H27NO6
Exact Mass 449.183838 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9WHRyaFog8i
Name 3,5-pyridinedicarboxylic acid, 4-(1,3-benzodioxol-5-yl)-1-(3,5-dimethylphenyl)-1,4-dihydro-, 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 449.183837587 u
Formula C26H27NO6
InChI InChI=1S/C26H27NO6/c1-5-30-25(28)20-13-27(19-10-16(3)9-17(4)11-19)14-21(26(29)31-6-2)24(20)18-7-8-22-23(12-18)33-15-32-22/h7-14,24H,5-6,15H2,1-4H3
InChIKey ZRDSQYPMLWJCAF-UHFFFAOYSA-N
Molecular Weight 449.503 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_9382
Solvent DMSO-d6
Source Vendor ID: NMR/10240541; Lab Info: SAS; Lab Number: SAS-tst3729
Temperature 23.85 °C