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3-quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-4-(3-hydroxyphenyl)-2-methyl-5-oxo-, cycloheptyl ester
SpectraBase Compound ID 9UM5n02PQ8J
InChI InChI=1S/C24H29NO4/c1-15-21(24(28)29-18-10-4-2-3-5-11-18)22(16-8-6-9-17(26)14-16)23-19(25-15)12-7-13-20(23)27/h6,8-9,14,18,22,25-26H,2-5,7,10-13H2,1H3
InChIKey YBQBCFRFSKVWBR-UHFFFAOYSA-N
Mol Weight 395.5 g/mol
Molecular Formula C24H29NO4
Exact Mass 395.209658 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LFxI8yZCwqM
Name 3-quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-4-(3-hydroxyphenyl)-2-methyl-5-oxo-, cycloheptyl 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 395.209658414 u
Formula C24H29NO4
InChI InChI=1S/C24H29NO4/c1-15-21(24(28)29-18-10-4-2-3-5-11-18)22(16-8-6-9-17(26)14-16)23-19(25-15)12-7-13-20(23)27/h6,8-9,14,18,22,25-26H,2-5,7,10-13H2,1H3
InChIKey YBQBCFRFSKVWBR-UHFFFAOYSA-N
Molecular Weight 395.499 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_18087
Solvent DMSO-d6
Source Vendor ID: NMR/11270799; Lab Info: SAS; Lab Number: SAS-tst5169