For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
ethyl 4-(4-{[(4-chlorophenyl)sulfanyl]methyl}-5-methyl-2-thienyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
SpectraBase Compound ID 1bpgm2taZVa
InChI InChI=1S/C27H30ClNO3S2/c1-6-32-26(31)23-15(2)29-20-12-27(4,5)13-21(30)24(20)25(23)22-11-17(16(3)34-22)14-33-19-9-7-18(28)8-10-19/h7-11,25,29H,6,12-14H2,1-5H3
InChIKey UWEFHXGEWWDZAV-UHFFFAOYSA-N
Mol Weight 516.11 g/mol
Molecular Formula C27H30ClNO3S2
Exact Mass 515.135564 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 8tZKvr8GqeW
Name ethyl 4-(4-{[(4-chlorophenyl)sulfanyl]methyl}-5-methyl-2-thienyl)-2,7,7-trimethyl-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/C27H30ClNO3S2/c1-6-32-26(31)23-15(2)29-20-12-27(4,5)13-21(30)24(20)25(23)22-11-17(16(3)34-22)14-33-19-9-7-18(28)8-10-19/h7-11,25,29H,6,12-14H2,1-5H3
InChIKey UWEFHXGEWWDZAV-UHFFFAOYSA-N
NMR Offset 17.5268
NMR Spectrometer Frequency 500.138
Observed nucleus 1H
Origin 1H_UBI_21270_14270
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/1012762; UBI_ID: UBI-014273
Temperature 300 °C