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3-quinolinecarboxylic acid, 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-7-(4-chlorophenyl)-1,4,5,6,7,8-hexahydro-2-methyl-5-oxo-, 1-methylethyl ester

View entire compound with spectra: 1 NMR

3-quinolinecarboxylic acid, 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-7-(4-chlorophenyl)-1,4,5,6,7,8-hexahydro-2-methyl-5-oxo-, 1-methylethyl ester
SpectraBase Compound ID JVG3KKRVVvB
InChI InChI=1S/C27H27BrClNO5/c1-13(2)35-27(33)23-14(3)30-20-10-16(15-5-7-18(29)8-6-15)11-21(31)25(20)24(23)17-9-19(28)26(32)22(12-17)34-4/h5-9,12-13,16,24,30,32H,10-11H2,1-4H3
InChIKey OSHRVAZBLVYRAC-UHFFFAOYSA-N
Mol Weight 560.87 g/mol
Molecular Formula C27H27BrClNO5
Exact Mass 559.076114 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JB7v6Q4uS4B
Name 3-quinolinecarboxylic acid, 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-7-(4-chlorophenyl)-1,4,5,6,7,8-hexahydro-2-methyl-5-oxo-, 1-methylethyl 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 559.076113668 u
Formula C27H27BrClNO5
InChI InChI=1S/C27H27BrClNO5/c1-13(2)35-27(33)23-14(3)30-20-10-16(15-5-7-18(29)8-6-15)11-21(31)25(20)24(23)17-9-19(28)26(32)22(12-17)34-4/h5-9,12-13,16,24,30,32H,10-11H2,1-4H3
InChIKey OSHRVAZBLVYRAC-UHFFFAOYSA-N
Molecular Weight 560.872 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_871
Solvent DMSO-d6
Source Vendor ID: ZI/8105763; Lab Info: SAS; Lab Number: SAS-nw11312