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2-[(2,5-dioxo-1-phenyl-3-pyrrolidinyl)sulfanyl]-6-methyl-4-(trifluoromethyl)nicotinonitrile
SpectraBase Compound ID I7VH52tMMlh
InChI InChI=1S/C18H12F3N3O2S/c1-10-7-13(18(19,20)21)12(9-22)16(23-10)27-14-8-15(25)24(17(14)26)11-5-3-2-4-6-11/h2-7,14H,8H2,1H3
InChIKey CRBGXYKHQNQWAZ-UHFFFAOYSA-N
Mol Weight 391.37 g/mol
Molecular Formula C18H12F3N3O2S
Exact Mass 391.060232 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4qqrtvxouzu
Name 2-[(2,5-dioxo-1-phenyl-3-pyrrolidinyl)sulfanyl]-6-methyl-4-(trifluoromethyl)nicotinonitrile
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/C18H12F3N3O2S/c1-10-7-13(18(19,20)21)12(9-22)16(23-10)27-14-8-15(25)24(17(14)26)11-5-3-2-4-6-11/h2-7,14H,8H2,1H3
InChIKey CRBGXYKHQNQWAZ-UHFFFAOYSA-N
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_2734
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/9216307; Labnumber: FNG-0000005