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methyl 4-{5-bromo-2-[(4-chlorobenzyl)oxy]phenyl}-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
SpectraBase Compound ID BpPl1q6g00e
InChI InChI=1S/C25H23BrClNO4/c1-14-22(25(30)31-2)23(24-19(28-14)4-3-5-20(24)29)18-12-16(26)8-11-21(18)32-13-15-6-9-17(27)10-7-15/h6-12,23,28H,3-5,13H2,1-2H3
InChIKey KXEUNBOODOWRSH-UHFFFAOYSA-N
Mol Weight 516.82 g/mol
Molecular Formula C25H23BrClNO4
Exact Mass 515.049899 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DVivsQOwCFi
Name methyl 4-{5-bromo-2-[(4-chlorobenzyl)oxy]phenyl}-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/C25H23BrClNO4/c1-14-22(25(30)31-2)23(24-19(28-14)4-3-5-20(24)29)18-12-16(26)8-11-21(18)32-13-15-6-9-17(27)10-7-15/h6-12,23,28H,3-5,13H2,1-2H3
InChIKey KXEUNBOODOWRSH-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_18276
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/1029353; Labnumber: TSI4006; UZI_ID: UZI-018283
Temperature 318 °C