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3-quinolinecarboxylic acid, 4-(3-ethoxy-4-hydroxyphenyl)-1,4,5,6,7,8-hexahydro-2-methyl-5-oxo-7-phenyl-, propyl ester

View entire compound with spectra: 1 NMR

3-quinolinecarboxylic acid, 4-(3-ethoxy-4-hydroxyphenyl)-1,4,5,6,7,8-hexahydro-2-methyl-5-oxo-7-phenyl-, propyl ester
SpectraBase Compound ID 53JYjdya0fB
InChI InChI=1S/C28H31NO5/c1-4-13-34-28(32)25-17(3)29-21-14-20(18-9-7-6-8-10-18)15-23(31)27(21)26(25)19-11-12-22(30)24(16-19)33-5-2/h6-12,16,20,26,29-30H,4-5,13-15H2,1-3H3
InChIKey XPTHWTLGSFYZSG-UHFFFAOYSA-N
Mol Weight 461.56 g/mol
Molecular Formula C28H31NO5
Exact Mass 461.220223 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Br3GtHVAKa7
Name 3-quinolinecarboxylic acid, 4-(3-ethoxy-4-hydroxyphenyl)-1,4,5,6,7,8-hexahydro-2-methyl-5-oxo-7-phenyl-, propyl 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 461.220223097 u
Formula C28H31NO5
InChI InChI=1S/C28H31NO5/c1-4-13-34-28(32)25-17(3)29-21-14-20(18-9-7-6-8-10-18)15-23(31)27(21)26(25)19-11-12-22(30)24(16-19)33-5-2/h6-12,16,20,26,29-30H,4-5,13-15H2,1-3H3
InChIKey XPTHWTLGSFYZSG-UHFFFAOYSA-N
Molecular Weight 461.558 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_873
Solvent DMSO-d6
Source Vendor ID: ZI/8116307; Lab Info: SAS; Lab Number: SAS-nw12014