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3-quinolinecarboxylic acid, 4-(5-bromo-2-methoxyphenyl)-1,4,5,6,7,8-hexahydro-2-methyl-5-oxo-, methyl ester
SpectraBase Compound ID FTq7V0fUXxN
InChI InChI=1S/C19H20BrNO4/c1-10-16(19(23)25-3)17(12-9-11(20)7-8-15(12)24-2)18-13(21-10)5-4-6-14(18)22/h7-9,17,21H,4-6H2,1-3H3
InChIKey GQTAKHZAYOMMGM-UHFFFAOYSA-N
Mol Weight 406.28 g/mol
Molecular Formula C19H20BrNO4
Exact Mass 405.057571 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IDK1G8CG9IZ
Name 3-quinolinecarboxylic acid, 4-(5-bromo-2-methoxyphenyl)-1,4,5,6,7,8-hexahydro-2-methyl-5-oxo-, methyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 405.057571124 u
Formula C19H20BrNO4
InChI InChI=1S/C19H20BrNO4/c1-10-16(19(23)25-3)17(12-9-11(20)7-8-15(12)24-2)18-13(21-10)5-4-6-14(18)22/h7-9,17,21H,4-6H2,1-3H3
InChIKey GQTAKHZAYOMMGM-UHFFFAOYSA-N
Molecular Weight 406.276 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_11228
Solvent DMSO-d6
Source Vendor ID: NMR/10251723; Lab Info: SAS; Lab Number: SAS-tst3764
Temperature 29.85 °C