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3,5-pyridinedicarbonitrile, 2-amino-4-[4-(1-methylethyl)phenyl]-6-[[2-(2-naphthalenyl)-2-oxoethyl]thio]-
SpectraBase Compound ID 7cMKtYR7M3D
InChI InChI=1S/C28H22N4OS/c1-17(2)18-7-10-20(11-8-18)26-23(14-29)27(31)32-28(24(26)15-30)34-16-25(33)22-12-9-19-5-3-4-6-21(19)13-22/h3-13,17H,16H2,1-2H3,(H2,31,32)
InChIKey WWCFMZXELCFRMS-UHFFFAOYSA-N
Mol Weight 462.57 g/mol
Molecular Formula C28H22N4OS
Exact Mass 462.151433 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FZUoDMisJhP
Name 3,5-pyridinedicarbonitrile, 2-amino-4-[4-(1-methylethyl)phenyl]-6-[[2-(2-naphthalenyl)-2-oxoethyl]thio]-
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/C28H22N4OS/c1-17(2)18-7-10-20(11-8-18)26-23(14-29)27(31)32-28(24(26)15-30)34-16-25(33)22-12-9-19-5-3-4-6-21(19)13-22/h3-13,17H,16H2,1-2H3,(H2,31,32)
InChIKey WWCFMZXELCFRMS-UHFFFAOYSA-N
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Origin 1H_CB_8313_2312
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: NMR/9253102; Labnumber: DVD-0000058
Temperature 297 °C