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3,5-pyridinedicarboxylic acid, 1,4-dihydro-1-(phenylmethyl)-4-(3,4,5-trimethoxyphenyl)-, dimethyl ester
SpectraBase Compound ID IXPc1VEIVqX
InChI InChI=1S/C25H27NO7/c1-29-20-11-17(12-21(30-2)23(20)31-3)22-18(24(27)32-4)14-26(15-19(22)25(28)33-5)13-16-9-7-6-8-10-16/h6-12,14-15,22H,13H2,1-5H3
InChIKey QBGLQLKLSKZRQW-UHFFFAOYSA-N
Mol Weight 453.49 g/mol
Molecular Formula C25H27NO7
Exact Mass 453.178752 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6yJdoYzY76D
Name 3,5-pyridinedicarboxylic acid, 1,4-dihydro-1-(phenylmethyl)-4-(3,4,5-trimethoxyphenyl)-, 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 453.178752206 u
Formula C25H27NO7
InChI InChI=1S/C25H27NO7/c1-29-20-11-17(12-21(30-2)23(20)31-3)22-18(24(27)32-4)14-26(15-19(22)25(28)33-5)13-16-9-7-6-8-10-16/h6-12,14-15,22H,13H2,1-5H3
InChIKey QBGLQLKLSKZRQW-UHFFFAOYSA-N
Molecular Weight 453.491 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_8864
Solvent DMSO-d6
Source Vendor ID: NMR/10230929; Lab Info: SAS; Lab Number: SAS-tst3591
Temperature 23.85 °C