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3-quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-7-(4-methoxyphenyl)-2-methyl-4-(4-nitrophenyl)-5-oxo-, cyclopentyl ester
SpectraBase Compound ID 21dpHxveARw
InChI InChI=1S/C29H30N2O6/c1-17-26(29(33)37-23-5-3-4-6-23)27(19-7-11-21(12-8-19)31(34)35)28-24(30-17)15-20(16-25(28)32)18-9-13-22(36-2)14-10-18/h7-14,20,23,27,30H,3-6,15-16H2,1-2H3
InChIKey KAHLZJAREMAVNQ-UHFFFAOYSA-N
Mol Weight 502.57 g/mol
Molecular Formula C29H30N2O6
Exact Mass 502.210387 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5BDNHYO3uIL
Name 3-quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-7-(4-methoxyphenyl)-2-methyl-4-(4-nitrophenyl)-5-oxo-, cyclopentyl 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 502.210386688 u
Formula C29H30N2O6
InChI InChI=1S/C29H30N2O6/c1-17-26(29(33)37-23-5-3-4-6-23)27(19-7-11-21(12-8-19)31(34)35)28-24(30-17)15-20(16-25(28)32)18-9-13-22(36-2)14-10-18/h7-14,20,23,27,30H,3-6,15-16H2,1-2H3
InChIKey KAHLZJAREMAVNQ-UHFFFAOYSA-N
Molecular Weight 502.567 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_1360
Solvent DMSO-d6
Source Vendor ID: ZI/8103099; Lab Info: SAS; Lab Number: SAS-nw10242