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2-amino-4-[4-methoxy-3-(phenoxymethyl)phenyl]-7,7-dimethyl-5-oxo-1-(3-pyridinyl)-1,4,5,6,7,8-hexahydro-3-quinolinecarbonitrile

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2-amino-4-[4-methoxy-3-(phenoxymethyl)phenyl]-7,7-dimethyl-5-oxo-1-(3-pyridinyl)-1,4,5,6,7,8-hexahydro-3-quinolinecarbonitrile
SpectraBase Compound ID AIxixNw55B8
InChI InChI=1S/C31H30N4O3/c1-31(2)15-25-29(26(36)16-31)28(24(17-32)30(33)35(25)22-8-7-13-34-18-22)20-11-12-27(37-3)21(14-20)19-38-23-9-5-4-6-10-23/h4-14,18,28H,15-16,19,33H2,1-3H3
InChIKey WAQCNICDDLBRJJ-UHFFFAOYSA-N
Mol Weight 506.61 g/mol
Molecular Formula C31H30N4O3
Exact Mass 506.231791 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IJQahNtNtEf
Name 2-amino-4-[4-methoxy-3-(phenoxymethyl)phenyl]-7,7-dimethyl-5-oxo-1-(3-pyridinyl)-1,4,5,6,7,8-hexahydro-3-quinolinecarbonitrile
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C31H30N4O3/c1-31(2)15-25-29(26(36)16-31)28(24(17-32)30(33)35(25)22-8-7-13-34-18-22)20-11-12-27(37-3)21(14-20)19-38-23-9-5-4-6-10-23/h4-14,18,28H,15-16,19,33H2,1-3H3
InChIKey WAQCNICDDLBRJJ-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_2518
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/9158226; Labnumber: AR-ALD/3151; UZI_ID: UZI-002520
Temperature 308 °C