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2-(ethylsulfanyl)ethyl 4-(4-hydroxy-3-methoxyphenyl)-7-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate

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2-(ethylsulfanyl)ethyl 4-(4-hydroxy-3-methoxyphenyl)-7-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
SpectraBase Compound ID 5nmaYjHdfNZ
InChI InChI=1S/C29H33NO6S/c1-5-37-13-12-36-29(33)26-17(2)30-22-14-20(18-6-9-21(34-3)10-7-18)15-24(32)28(22)27(26)19-8-11-23(31)25(16-19)35-4/h6-11,16,20,27,30-31H,5,12-15H2,1-4H3
InChIKey KRFHGTFZTYTBGW-UHFFFAOYSA-N
Mol Weight 523.6 g/mol
Molecular Formula C29H33NO6S
Exact Mass 523.202859 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6WLVjMxqoPp
Name 2-(ethylsulfanyl)ethyl 4-(4-hydroxy-3-methoxyphenyl)-7-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C29H33NO6S/c1-5-37-13-12-36-29(33)26-17(2)30-22-14-20(18-6-9-21(34-3)10-7-18)15-24(32)28(22)27(26)19-8-11-23(31)25(16-19)35-4/h6-11,16,20,27,30-31H,5,12-15H2,1-4H3
InChIKey KRFHGTFZTYTBGW-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_18191
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: UZI/9120458; UBI_ID: UBI-018194
Temperature 308 °C