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3-quinolinecarboxylic acid, 4-(2-chloro-5-nitrophenyl)-1,4,5,6,7,8-hexahydro-2-methyl-5-oxo-, cyclohexyl ester
SpectraBase Compound ID 10mZdyXA9i5
InChI InChI=1S/C23H25ClN2O5/c1-13-20(23(28)31-15-6-3-2-4-7-15)21(22-18(25-13)8-5-9-19(22)27)16-12-14(26(29)30)10-11-17(16)24/h10-12,15,21,25H,2-9H2,1H3
InChIKey IPOXFBRCQVZDRD-UHFFFAOYSA-N
Mol Weight 444.92 g/mol
Molecular Formula C23H25ClN2O5
Exact Mass 444.1452 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5RQl3kWMq7R
Name 3-quinolinecarboxylic acid, 4-(2-chloro-5-nitrophenyl)-1,4,5,6,7,8-hexahydro-2-methyl-5-oxo-, cyclohexyl 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/C23H25ClN2O5/c1-13-20(23(28)31-15-6-3-2-4-7-15)21(22-18(25-13)8-5-9-19(22)27)16-12-14(26(29)30)10-11-17(16)24/h10-12,15,21,25H,2-9H2,1H3
InChIKey IPOXFBRCQVZDRD-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_498
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/11258300