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3-quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-2-methyl-4-[4-(1-methylethyl)phenyl]-5-oxo-, methyl ester
SpectraBase Compound ID BvcLIgLDA1u
InChI InChI=1S/C21H25NO3/c1-12(2)14-8-10-15(11-9-14)19-18(21(24)25-4)13(3)22-16-6-5-7-17(23)20(16)19/h8-12,19,22H,5-7H2,1-4H3
InChIKey YEARWLCUQCSXBV-UHFFFAOYSA-N
Mol Weight 339.44 g/mol
Molecular Formula C21H25NO3
Exact Mass 339.183444 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2HsEGijutHw
Name 3-quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-2-methyl-4-[4-(1-methylethyl)phenyl]-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 339.183443666 u
Formula C21H25NO3
InChI InChI=1S/C21H25NO3/c1-12(2)14-8-10-15(11-9-14)19-18(21(24)25-4)13(3)22-16-6-5-7-17(23)20(16)19/h8-12,19,22H,5-7H2,1-4H3
InChIKey YEARWLCUQCSXBV-UHFFFAOYSA-N
Molecular Weight 339.435 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_11227
Solvent DMSO-d6
Source Vendor ID: NMR/10251718; Lab Info: SAS; Lab Number: SAS-tst3759
Temperature 29.85 °C