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3,5-pyridinedicarboxylic acid, 1,4-dihydro-1,2,6-trimethyl-4-[2-(phenylmethoxy)phenyl]-, dimethyl ester
SpectraBase Compound ID 3BbNWR8xYHt
InChI InChI=1S/C25H27NO5/c1-16-21(24(27)29-4)23(22(25(28)30-5)17(2)26(16)3)19-13-9-10-14-20(19)31-15-18-11-7-6-8-12-18/h6-14,23H,15H2,1-5H3
InChIKey DFABXQQHSXLLRG-UHFFFAOYSA-N
Mol Weight 421.49 g/mol
Molecular Formula C25H27NO5
Exact Mass 421.188923 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4DN0fTwmbpW
Name 3,5-pyridinedicarboxylic acid, 1,4-dihydro-1,2,6-trimethyl-4-[2-(phenylmethoxy)phenyl]-, 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 421.188922968 u
Formula C25H27NO5
InChI InChI=1S/C25H27NO5/c1-16-21(24(27)29-4)23(22(25(28)30-5)17(2)26(16)3)19-13-9-10-14-20(19)31-15-18-11-7-6-8-12-18/h6-14,23H,15H2,1-5H3
InChIKey DFABXQQHSXLLRG-UHFFFAOYSA-N
Molecular Weight 421.493 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_8088
Solvent DMSO-d6
Source Vendor ID: NMR/9291181; Lab Info: SAS; Lab Number: SAS-tst2919
Temperature 29.85 °C