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3,5-pyridinedicarboxylic acid, 4-(3-bromo-4,5-dimethoxyphenyl)-1-cyclopropyl-1,4-dihydro-, dimethyl ester

View entire compound with spectra: 1 NMR

3,5-pyridinedicarboxylic acid, 4-(3-bromo-4,5-dimethoxyphenyl)-1-cyclopropyl-1,4-dihydro-, dimethyl ester
SpectraBase Compound ID 6iGXe9UU86e
InChI InChI=1S/C20H22BrNO6/c1-25-16-8-11(7-15(21)18(16)26-2)17-13(19(23)27-3)9-22(12-5-6-12)10-14(17)20(24)28-4/h7-10,12,17H,5-6H2,1-4H3
InChIKey IXQCCIIHRVHWKT-UHFFFAOYSA-N
Mol Weight 452.3 g/mol
Molecular Formula C20H22BrNO6
Exact Mass 451.06305 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4yPejLuaggk
Name 3,5-pyridinedicarboxylic acid, 4-(3-bromo-4,5-dimethoxyphenyl)-1-cyclopropyl-1,4-dihydro-, 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 451.063050426 u
Formula C20H22BrNO6
InChI InChI=1S/C20H22BrNO6/c1-25-16-8-11(7-15(21)18(16)26-2)17-13(19(23)27-3)9-22(12-5-6-12)10-14(17)20(24)28-4/h7-10,12,17H,5-6H2,1-4H3
InChIKey IXQCCIIHRVHWKT-UHFFFAOYSA-N
Molecular Weight 452.301 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_16392
Solvent DMSO-d6
Source Vendor ID: NMR/10311547; Lab Info: SAS; Lab Number: SAS-tst4342