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ethyl 4-{4-[(4-bromophenoxy)methyl]-5-ethyl-2-thienyl}-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
SpectraBase Compound ID 38RwSyrtIrU
InChI InChI=1S/C26H28BrNO4S/c1-4-21-16(14-32-18-11-9-17(27)10-12-18)13-22(33-21)25-23(26(30)31-5-2)15(3)28-19-7-6-8-20(29)24(19)25/h9-13,25,28H,4-8,14H2,1-3H3
InChIKey RYECWOXYDXDERJ-UHFFFAOYSA-N
Mol Weight 530.48 g/mol
Molecular Formula C26H28BrNO4S
Exact Mass 529.092243 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7w15on6pMVX
Name ethyl 4-{4-[(4-bromophenoxy)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/C26H28BrNO4S/c1-4-21-16(14-32-18-11-9-17(27)10-12-18)13-22(33-21)25-23(26(30)31-5-2)15(3)28-19-7-6-8-20(29)24(19)25/h9-13,25,28H,4-8,14H2,1-3H3
InChIKey RYECWOXYDXDERJ-UHFFFAOYSA-N
NMR Offset 17.5285
NMR Spectrometer Frequency 500.138
Observed nucleus 1H
Origin 1H_UBI_21270_14313
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/1013587; UBI_ID: UBI-014316
Temperature 300 °C