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methyl 4-{4-[(2-chloro-4-fluorophenoxy)methyl]-5-methyl-2-thienyl}-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate

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methyl 4-{4-[(2-chloro-4-fluorophenoxy)methyl]-5-methyl-2-thienyl}-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
SpectraBase Compound ID DaVmmJkf635
InChI InChI=1S/C24H23ClFNO4S/c1-12-21(24(29)30-3)23(22-17(27-12)5-4-6-18(22)28)20-9-14(13(2)32-20)11-31-19-8-7-15(26)10-16(19)25/h7-10,23,27H,4-6,11H2,1-3H3
InChIKey UNGRSTTUHHKJII-UHFFFAOYSA-N
Mol Weight 475.96 g/mol
Molecular Formula C24H23ClFNO4S
Exact Mass 475.102035 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2HBtaMhrvT9
Name methyl 4-{4-[(2-chloro-4-fluorophenoxy)methyl]-5-methyl-2-thienyl}-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C24H23ClFNO4S/c1-12-21(24(29)30-3)23(22-17(27-12)5-4-6-18(22)28)20-9-14(13(2)32-20)11-31-19-8-7-15(26)10-16(19)25/h7-10,23,27H,4-6,11H2,1-3H3
InChIKey UNGRSTTUHHKJII-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_14159
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/1011017; UBI_ID: UBI-014162
Temperature 308 °C