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2-amino-4-{3-[(2-chloro-4-fluorophenoxy)methyl]-4-methoxyphenyl}-5,6,7,8-tetrahydro-3-quinolinecarbonitrile
SpectraBase Compound ID ES1n2WhsXiv
InChI InChI=1S/C24H21ClFN3O2/c1-30-21-8-6-14(10-15(21)13-31-22-9-7-16(26)11-19(22)25)23-17-4-2-3-5-20(17)29-24(28)18(23)12-27/h6-11H,2-5,13H2,1H3,(H2,28,29)
InChIKey AEVIWDMPEPQNCG-UHFFFAOYSA-N
Mol Weight 437.9 g/mol
Molecular Formula C24H21ClFN3O2
Exact Mass 437.130633 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID A7n7UVcc4Xt
Name 2-amino-4-{3-[(2-chloro-4-fluorophenoxy)methyl]-4-methoxyphenyl}-5,6,7,8-tetrahydro-3-quinolinecarbonitrile
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/C24H21ClFN3O2/c1-30-21-8-6-14(10-15(21)13-31-22-9-7-16(26)11-19(22)25)23-17-4-2-3-5-20(17)29-24(28)18(23)12-27/h6-11H,2-5,13H2,1H3,(H2,28,29)
InChIKey AEVIWDMPEPQNCG-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_7275
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: 9686902; UBI_ID: UBI-007278
Temperature 318 °C