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3,5-pyridinedicarboxylic acid, 1-[(4-chlorophenyl)methyl]-1,4-dihydro-4-(3,4,5-trimethoxyphenyl)-, dimethyl ester
SpectraBase Compound ID IzfXgvJTOzR
InChI InChI=1S/C25H26ClNO7/c1-30-20-10-16(11-21(31-2)23(20)32-3)22-18(24(28)33-4)13-27(14-19(22)25(29)34-5)12-15-6-8-17(26)9-7-15/h6-11,13-14,22H,12H2,1-5H3
InChIKey GTHXFJCXRJXGSN-UHFFFAOYSA-N
Mol Weight 487.94 g/mol
Molecular Formula C25H26ClNO7
Exact Mass 487.13978 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4yf4jkCgGsF
Name 3,5-pyridinedicarboxylic acid, 1-[(4-chlorophenyl)methyl]-1,4-dihydro-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 487.139779874 u
Formula C25H26ClNO7
InChI InChI=1S/C25H26ClNO7/c1-30-20-10-16(11-21(31-2)23(20)32-3)22-18(24(28)33-4)13-27(14-19(22)25(29)34-5)12-15-6-8-17(26)9-7-15/h6-11,13-14,22H,12H2,1-5H3
InChIKey GTHXFJCXRJXGSN-UHFFFAOYSA-N
Molecular Weight 487.936 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_9565
Solvent DMSO-d6
Source Vendor ID: NMR/10241035; Lab Info: SAS; Lab Number: SAS-tst3616
Temperature 23.85 °C