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3-quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-2,7,7-trimethyl-5-oxo-4-(4-oxo-4H-1-benzopyran-3-yl)-, ethyl ester
SpectraBase Compound ID El3RYQi5Rm0
InChI InChI=1S/C24H25NO5/c1-5-29-23(28)19-13(2)25-16-10-24(3,4)11-17(26)21(16)20(19)15-12-30-18-9-7-6-8-14(18)22(15)27/h6-9,12,20,25H,5,10-11H2,1-4H3
InChIKey RFPWYHMOHQJULO-UHFFFAOYSA-N
Mol Weight 407.47 g/mol
Molecular Formula C24H25NO5
Exact Mass 407.173273 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HaEEiclHFtl
Name 3-quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-2,7,7-trimethyl-5-oxo-4-(4-oxo-4H-1-benzopyran-3-yl)-, ethyl 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 407.173272904 u
Formula C24H25NO5
InChI InChI=1S/C24H25NO5/c1-5-29-23(28)19-13(2)25-16-10-24(3,4)11-17(26)21(16)20(19)15-12-30-18-9-7-6-8-14(18)22(15)27/h6-9,12,20,25H,5,10-11H2,1-4H3
InChIKey RFPWYHMOHQJULO-UHFFFAOYSA-N
Molecular Weight 407.466 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_8225
Solvent DMSO-d6
Source Vendor ID: NMR/9254459; Lab Info: SAS; Lab Number: SAS-TST2109
Temperature 29.85 °C