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3-quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-4-[4-methoxy-3-(phenylmethoxy)phenyl]-2-methyl-5-oxo-, 2-(ethylthio)ethyl ester

View entire compound with spectra: 1 NMR

3-quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-4-[4-methoxy-3-(phenylmethoxy)phenyl]-2-methyl-5-oxo-, 2-(ethylthio)ethyl ester
SpectraBase Compound ID GCq8irutw0T
InChI InChI=1S/C29H33NO5S/c1-4-36-16-15-34-29(32)26-19(2)30-22-11-8-12-23(31)28(22)27(26)21-13-14-24(33-3)25(17-21)35-18-20-9-6-5-7-10-20/h5-7,9-10,13-14,17,27,30H,4,8,11-12,15-16,18H2,1-3H3
InChIKey ZDMIYPVKRJXUNU-UHFFFAOYSA-N
Mol Weight 507.6 g/mol
Molecular Formula C29H33NO5S
Exact Mass 507.207944 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID I4T1sBCZKrv
Name 3-quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-4-[4-methoxy-3-(phenylmethoxy)phenyl]-2-methyl-5-oxo-, 2-(ethylthio)ethyl 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 507.207944336 u
Formula C29H33NO5S
InChI InChI=1S/C29H33NO5S/c1-4-36-16-15-34-29(32)26-19(2)30-22-11-8-12-23(31)28(22)27(26)21-13-14-24(33-3)25(17-21)35-18-20-9-6-5-7-10-20/h5-7,9-10,13-14,17,27,30H,4,8,11-12,15-16,18H2,1-3H3
InChIKey ZDMIYPVKRJXUNU-UHFFFAOYSA-N
Molecular Weight 507.645 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_11180
Solvent DMSO-d6
Source Vendor ID: NMR/10251638; Lab Info: SAS; Lab Number: SAS-tst3674
Temperature 29.85 °C