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ethyl 4-(5-{[(4-chlorophenyl)sulfanyl]methyl}-2,4-dimethylphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate

View entire compound with spectra: 1 NMR

ethyl 4-(5-{[(4-chlorophenyl)sulfanyl]methyl}-2,4-dimethylphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
SpectraBase Compound ID A7cQ3DtuSTT
InChI InChI=1S/C28H30ClNO3S/c1-5-33-28(32)25-18(4)30-23-7-6-8-24(31)27(23)26(25)22-14-19(16(2)13-17(22)3)15-34-21-11-9-20(29)10-12-21/h9-14,26,30H,5-8,15H2,1-4H3
InChIKey LSDSUMJAEMWVLP-UHFFFAOYSA-N
Mol Weight 496.07 g/mol
Molecular Formula C28H30ClNO3S
Exact Mass 495.163493 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KrMHYZyTHra
Name ethyl 4-(5-{[(4-chlorophenyl)sulfanyl]methyl}-2,4-dimethylphenyl)-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/C28H30ClNO3S/c1-5-33-28(32)25-18(4)30-23-7-6-8-24(31)27(23)26(25)22-14-19(16(2)13-17(22)3)15-34-21-11-9-20(29)10-12-21/h9-14,26,30H,5-8,15H2,1-4H3
InChIKey LSDSUMJAEMWVLP-UHFFFAOYSA-N
NMR Offset 17.5268
NMR Spectrometer Frequency 500.138
Observed nucleus 1H
Origin 1H_UBI_21270_14450
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/1016867; UBI_ID: UBI-014453
Temperature 300 °C