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3-quinolinecarboxylic acid, 4-(2-chloro-5-nitrophenyl)-1,4,5,6,7,8-hexahydro-2,7,7-trimethyl-5-oxo-, (4-methoxyphenyl)methyl ester

View entire compound with spectra: 1 NMR

3-quinolinecarboxylic acid, 4-(2-chloro-5-nitrophenyl)-1,4,5,6,7,8-hexahydro-2,7,7-trimethyl-5-oxo-, (4-methoxyphenyl)methyl ester
SpectraBase Compound ID 4pTLadmM347
InChI InChI=1S/C27H27ClN2O6/c1-15-23(26(32)36-14-16-5-8-18(35-4)9-6-16)24(19-11-17(30(33)34)7-10-20(19)28)25-21(29-15)12-27(2,3)13-22(25)31/h5-11,24,29H,12-14H2,1-4H3
InChIKey NQXVDAUQUDEQGR-UHFFFAOYSA-N
Mol Weight 510.97 g/mol
Molecular Formula C27H27ClN2O6
Exact Mass 510.155764 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3rAsVqgyZva
Name 3-quinolinecarboxylic acid, 4-(2-chloro-5-nitrophenyl)-1,4,5,6,7,8-hexahydro-2,7,7-trimethyl-5-oxo-, (4-methoxyphenyl)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 510.155764291 u
Formula C27H27ClN2O6
InChI InChI=1S/C27H27ClN2O6/c1-15-23(26(32)36-14-16-5-8-18(35-4)9-6-16)24(19-11-17(30(33)34)7-10-20(19)28)25-21(29-15)12-27(2,3)13-22(25)31/h5-11,24,29H,12-14H2,1-4H3
InChIKey NQXVDAUQUDEQGR-UHFFFAOYSA-N
Molecular Weight 510.974 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_11209
Solvent DMSO-d6
Source Vendor ID: NMR/10251694; Lab Info: SAS; Lab Number: SAS-tst3734
Temperature 29.85 °C