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3-quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-4-(3-hydroxy-4-methoxyphenyl)-2,7,7-trimethyl-5-oxo-, cyclopentyl ester

View entire compound with spectra: 1 NMR

3-quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-4-(3-hydroxy-4-methoxyphenyl)-2,7,7-trimethyl-5-oxo-, cyclopentyl ester
SpectraBase Compound ID 9dyxVnZAGmi
InChI InChI=1S/C25H31NO5/c1-14-21(24(29)31-16-7-5-6-8-16)22(15-9-10-20(30-4)18(27)11-15)23-17(26-14)12-25(2,3)13-19(23)28/h9-11,16,22,26-27H,5-8,12-13H2,1-4H3
InChIKey ZOQUBAXSSNEJLD-UHFFFAOYSA-N
Mol Weight 425.53 g/mol
Molecular Formula C25H31NO5
Exact Mass 425.220223 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BRLkWY1Vv6D
Name 3-quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-4-(3-hydroxy-4-methoxyphenyl)-2,7,7-trimethyl-5-oxo-, cyclopentyl ester
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C25H31NO5/c1-14-21(24(29)31-16-7-5-6-8-16)22(15-9-10-20(30-4)18(27)11-15)23-17(26-14)12-25(2,3)13-19(23)28/h9-11,16,22,26-27H,5-8,12-13H2,1-4H3
InChIKey ZOQUBAXSSNEJLD-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_512
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: NMR/11258335