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2-amino-4-{4-methoxy-3-[(2,3,4,5,6-pentafluorophenoxy)methyl]phenyl}-5,6,7,8-tetrahydro-3-quinolinecarbonitrile
SpectraBase Compound ID 70WdPBPnHxS
InChI InChI=1S/C24H18F5N3O2/c1-33-16-7-6-11(17-13-4-2-3-5-15(13)32-24(31)14(17)9-30)8-12(16)10-34-23-21(28)19(26)18(25)20(27)22(23)29/h6-8H,2-5,10H2,1H3,(H2,31,32)
InChIKey CIMYHJURTQPFIY-UHFFFAOYSA-N
Mol Weight 475.42 g/mol
Molecular Formula C24H18F5N3O2
Exact Mass 475.131918 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID VlnLoJeJTt
Name 2-amino-4-{4-methoxy-3-[(2,3,4,5,6-pentafluorophenoxy)methyl]phenyl}-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/C24H18F5N3O2/c1-33-16-7-6-11(17-13-4-2-3-5-15(13)32-24(31)14(17)9-30)8-12(16)10-34-23-21(28)19(26)18(25)20(27)22(23)29/h6-8H,2-5,10H2,1H3,(H2,31,32)
InChIKey CIMYHJURTQPFIY-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_12744
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/9125074; UBI_ID: UBI-012747
Temperature 318 °C