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3-pyridinecarbonitrile, 2-[[(4-chlorophenyl)methyl]thio]-6-(2-thienyl)-4-(trifluoromethyl)-
SpectraBase Compound ID HuigkcYRpOi
InChI InChI=1S/C18H10ClF3N2S2/c19-12-5-3-11(4-6-12)10-26-17-13(9-23)14(18(20,21)22)8-15(24-17)16-2-1-7-25-16/h1-8H,10H2
InChIKey XOULUVBUXKOVNU-UHFFFAOYSA-N
Mol Weight 410.86 g/mol
Molecular Formula C18H10ClF3N2S2
Exact Mass 409.992603 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KD5ONnMLB9i
Name 3-pyridinecarbonitrile, 2-[[(4-chlorophenyl)methyl]thio]-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/C18H10ClF3N2S2/c19-12-5-3-11(4-6-12)10-26-17-13(9-23)14(18(20,21)22)8-15(24-17)16-2-1-7-25-16/h1-8H,10H2
InChIKey XOULUVBUXKOVNU-UHFFFAOYSA-N
NMR Offset 16.4447
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Origin 1H_ASIOH_8516_6566
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: TSH/5636654; IOH_ID: IOH-013570
Temperature 297 °C