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2-amino-1-(4-chlorophenyl)-5-oxo-4-(2,3,4,5,6-pentafluorophenyl)-1,4,5,6,7,8-hexahydro-3-quinolinecarbonitrile

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2-amino-1-(4-chlorophenyl)-5-oxo-4-(2,3,4,5,6-pentafluorophenyl)-1,4,5,6,7,8-hexahydro-3-quinolinecarbonitrile
SpectraBase Compound ID 3holKPlC4PR
InChI InChI=1S/C22H13ClF5N3O/c23-9-4-6-10(7-5-9)31-12-2-1-3-13(32)15(12)14(11(8-29)22(31)30)16-17(24)19(26)21(28)20(27)18(16)25/h4-7,14H,1-3,30H2
InChIKey LRFBOJZLPLUVKE-UHFFFAOYSA-N
Mol Weight 465.81 g/mol
Molecular Formula C22H13ClF5N3O
Exact Mass 465.066731 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6HTE5KUrCtm
Name 2-amino-1-(4-chlorophenyl)-5-oxo-4-(2,3,4,5,6-pentafluorophenyl)-1,4,5,6,7,8-hexahydro-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/C22H13ClF5N3O/c23-9-4-6-10(7-5-9)31-12-2-1-3-13(32)15(12)14(11(8-29)22(31)30)16-17(24)19(26)21(28)20(27)18(16)25/h4-7,14H,1-3,30H2
InChIKey LRFBOJZLPLUVKE-UHFFFAOYSA-N
NMR Offset 16.5281
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_10276
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/9070762; UBI_ID: UBI-010279
Temperature 308 °C