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6-(1,3-benzodioxol-5-yl)-2-sulfanylidene-4-(trifluoromethyl)-1H-pyridine-3-carbonitrile

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6-(1,3-benzodioxol-5-yl)-2-sulfanylidene-4-(trifluoromethyl)-1H-pyridine-3-carbonitrile
SpectraBase Compound ID 2FL4nlJbYHW
InChI InChI=1S/C14H7F3N2O2S/c15-14(16,17)9-4-10(19-13(22)8(9)5-18)7-1-2-11-12(3-7)21-6-20-11/h1-4H,6H2,(H,19,22)
InChIKey WXBKCEOFHYERSP-UHFFFAOYSA-N
Mol Weight 324.28 g/mol
Molecular Formula C14H7F3N2O2S
Exact Mass 324.018033 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IaLhwnQkcdF
Name 6-(1,3-benzodioxol-5-yl)-2-sulfanyl-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/C14H7F3N2O2S/c15-14(16,17)9-4-10(19-13(22)8(9)5-18)7-1-2-11-12(3-7)21-6-20-11/h1-4H,6H2,(H,19,22)
InChIKey WXBKCEOFHYERSP-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_9745
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: D60464; Labnumber: SHES3-0116; SBI_ID: SBI-009748
Temperature 308 °C