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6-bromo-2-(4-sec-butylphenyl)-3-methyl-4-quinolinecarboxylic acid

View entire compound with spectra: 1 NMR

6-bromo-2-(4-sec-butylphenyl)-3-methyl-4-quinolinecarboxylic acid
SpectraBase Compound ID 3PcfMHSNC1T
InChI InChI=1S/C21H20BrNO2/c1-4-12(2)14-5-7-15(8-6-14)20-13(3)19(21(24)25)17-11-16(22)9-10-18(17)23-20/h5-12H,4H2,1-3H3,(H,24,25)
InChIKey YMJMVVCOCCXSSD-UHFFFAOYSA-N
Mol Weight 398.3 g/mol
Molecular Formula C21H20BrNO2
Exact Mass 397.067742 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2rrha4mu1gn
Name 6-bromo-2-(4-sec-butylphenyl)-3-methyl-4-quinolinecarboxylic acid
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/C21H20BrNO2/c1-4-12(2)14-5-7-15(8-6-14)20-13(3)19(21(24)25)17-11-16(22)9-10-18(17)23-20/h5-12H,4H2,1-3H3,(H,24,25)
InChIKey YMJMVVCOCCXSSD-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_29687
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: 1026481; SBI_ID: SBI-029691
Temperature 308 °C