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2-(methylthio)-6-(2-thienyl)-4-(trifluoromethyl)nicotinonitrile
SpectraBase Compound ID gXSG4Iqgnu
InChI InChI=1S/C12H7F3N2S2/c1-18-11-7(6-16)8(12(13,14)15)5-9(17-11)10-3-2-4-19-10/h2-5H,1H3
InChIKey HETLUNBJOGPUSE-UHFFFAOYSA-N
Mol Weight 300.32 g/mol
Molecular Formula C12H7F3N2S2
Exact Mass 300.000275 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FLusFANmsCL
Name 3-pyridinecarbonitrile, 2-(methylthio)-6-(2-thienyl)-4-(trifluoromethyl)-
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/C12H7F3N2S2/c1-18-11-7(6-16)8(12(13,14)15)5-9(17-11)10-3-2-4-19-10/h2-5H,1H3
InChIKey HETLUNBJOGPUSE-UHFFFAOYSA-N
NMR Offset 16.0087
NMR Spectrometer Frequency 500.133
Observed nucleus 1H
Origin 1H_ASIOH_8516_74
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: AG-205/3061556; IOH_ID: IOH-007075