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ethyl 4-{4-[(2-chlorophenoxy)methyl]-5-ethyl-2-thienyl}-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
SpectraBase Compound ID B61vwNWWuYq
InChI InChI=1S/C26H28ClNO4S/c1-4-21-16(14-32-20-12-7-6-9-17(20)27)13-22(33-21)25-23(26(30)31-5-2)15(3)28-18-10-8-11-19(29)24(18)25/h6-7,9,12-13,25,28H,4-5,8,10-11,14H2,1-3H3
InChIKey GIFQHYUVBWVJDW-UHFFFAOYSA-N
Mol Weight 486.03 g/mol
Molecular Formula C26H28ClNO4S
Exact Mass 485.142757 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IeONGrqqfPd
Name ethyl 4-{4-[(2-chlorophenoxy)methyl]-5-ethyl-2-thienyl}-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/C26H28ClNO4S/c1-4-21-16(14-32-20-12-7-6-9-17(20)27)13-22(33-21)25-23(26(30)31-5-2)15(3)28-18-10-8-11-19(29)24(18)25/h6-7,9,12-13,25,28H,4-5,8,10-11,14H2,1-3H3
InChIKey GIFQHYUVBWVJDW-UHFFFAOYSA-N
NMR Offset 17.5285
NMR Spectrometer Frequency 500.138
Observed nucleus 1H
Origin 1H_UBI_21270_14446
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/1016767; UBI_ID: UBI-014449
Temperature 300 °C