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4-quinolinecarboxylic acid, 2-(2-thienyl)-, 2-(4-bromophenyl)-2-oxoethyl ester
SpectraBase Compound ID 6wnnu7y3iaY
InChI InChI=1S/C22H14BrNO3S/c23-15-9-7-14(8-10-15)20(25)13-27-22(26)17-12-19(21-6-3-11-28-21)24-18-5-2-1-4-16(17)18/h1-12H,13H2
InChIKey CYCPMBWPJSGHEB-UHFFFAOYSA-N
Mol Weight 452.32 g/mol
Molecular Formula C22H14BrNO3S
Exact Mass 450.987777 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HU22LbJDosm
Name 4-quinolinecarboxylic acid, 2-(2-thienyl)-, 2-(4-bromophenyl)-2-oxoethyl ester
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/C22H14BrNO3S/c23-15-9-7-14(8-10-15)20(25)13-27-22(26)17-12-19(21-6-3-11-28-21)24-18-5-2-1-4-16(17)18/h1-12H,13H2
InChIKey CYCPMBWPJSGHEB-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_8927
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: NMR/12259525