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4-{3-[(4-iodophenoxy)methyl]-4-methoxyphenyl}-2,7,7-trimethyl-5-oxo-N-(2-pyridinyl)-1,4,5,6,7,8-hexahydro-3-quinolinecarboxamide

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4-{3-[(4-iodophenoxy)methyl]-4-methoxyphenyl}-2,7,7-trimethyl-5-oxo-N-(2-pyridinyl)-1,4,5,6,7,8-hexahydro-3-quinolinecarboxamide
SpectraBase Compound ID 7zsZflAV5ic
InChI InChI=1S/C32H32IN3O4/c1-19-28(31(38)36-27-7-5-6-14-34-27)29(30-24(35-19)16-32(2,3)17-25(30)37)20-8-13-26(39-4)21(15-20)18-40-23-11-9-22(33)10-12-23/h5-15,29,35H,16-18H2,1-4H3,(H,34,36,38)
InChIKey NORYLGBXJDLGSS-UHFFFAOYSA-N
Mol Weight 649.5 g/mol
Molecular Formula C32H32IN3O4
Exact Mass 649.143752 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GxSJonUhlhN
Name 4-{3-[(4-iodophenoxy)methyl]-4-methoxyphenyl}-2,7,7-trimethyl-5-oxo-N-(2-pyridinyl)-1,4,5,6,7,8-hexahydro-3-quinolinecarboxamide
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/C32H32IN3O4/c1-19-28(31(38)36-27-7-5-6-14-34-27)29(30-24(35-19)16-32(2,3)17-25(30)37)20-8-13-26(39-4)21(15-20)18-40-23-11-9-22(33)10-12-23/h5-15,29,35H,16-18H2,1-4H3,(H,34,36,38)
InChIKey NORYLGBXJDLGSS-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_13557
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: UZI/9142719; UBI_ID: UBI-013560
Temperature 313 °C