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2-thiophenecarboxamide, N-[4-[2-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridinyl]thio]acetyl]phenyl]-
SpectraBase Compound ID 17IGbDdzMTI
InChI InChI=1S/C21H14F3N3O2S2/c1-12-9-16(21(22,23)24)15(10-25)20(26-12)31-11-17(28)13-4-6-14(7-5-13)27-19(29)18-3-2-8-30-18/h2-9H,11H2,1H3,(H,27,29)
InChIKey JRUNIAIZSSAKND-UHFFFAOYSA-N
Mol Weight 461.48 g/mol
Molecular Formula C21H14F3N3O2S2
Exact Mass 461.047954 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EIGSQMqaDd1
Name 2-thiophenecarboxamide, N-[4-[2-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridinyl]thio]acetyl]phenyl]-
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/C21H14F3N3O2S2/c1-12-9-16(21(22,23)24)15(10-25)20(26-12)31-11-17(28)13-4-6-14(7-5-13)27-19(29)18-3-2-8-30-18/h2-9H,11H2,1H3,(H,27,29)
InChIKey JRUNIAIZSSAKND-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_5848
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/18217329; Labnumber: OBK-8342