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2-{[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl}-6-methyl-4-(trifluoromethyl)nicotinonitrile
SpectraBase Compound ID 90OZ288ldbw
InChI InChI=1S/C18H15F3N2OS/c1-10-4-5-13(11(2)6-10)16(24)9-25-17-14(8-22)15(18(19,20)21)7-12(3)23-17/h4-7H,9H2,1-3H3
InChIKey WUVCXJZANXUXNQ-UHFFFAOYSA-N
Mol Weight 364.39 g/mol
Molecular Formula C18H15F3N2OS
Exact Mass 364.085719 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HVC6EoXBist
Name 2-{[2-(2,4-dimethylphenyl)-2-oxoethyl]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/C18H15F3N2OS/c1-10-4-5-13(11(2)6-10)16(24)9-25-17-14(8-22)15(18(19,20)21)7-12(3)23-17/h4-7H,9H2,1-3H3
InChIKey WUVCXJZANXUXNQ-UHFFFAOYSA-N
NMR Offset 13.9821
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_4668
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: ZI/5124075; Labnumber: TSH-4360; IOH_ID: IOH-004669
Temperature 297 °C