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3-pyridinecarbonitrile, 6-cyclopropyl-4-(4-fluorophenyl)-2-[[2-oxo-2-(2-thienyl)ethyl]thio]-
SpectraBase Compound ID KgxuKnPuc3a
InChI InChI=1S/C21H15FN2OS2/c22-15-7-5-13(6-8-15)16-10-18(14-3-4-14)24-21(17(16)11-23)27-12-19(25)20-2-1-9-26-20/h1-2,5-10,14H,3-4,12H2
InChIKey VXJUUKXADMTZQM-UHFFFAOYSA-N
Mol Weight 394.48 g/mol
Molecular Formula C21H15FN2OS2
Exact Mass 394.060984 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CJx0LGKZg0x
Name 3-pyridinecarbonitrile, 6-cyclopropyl-4-(4-fluorophenyl)-2-[[2-oxo-2-(2-thienyl)ethyl]thio]-
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/C21H15FN2OS2/c22-15-7-5-13(6-8-15)16-10-18(14-3-4-14)24-21(17(16)11-23)27-12-19(25)20-2-1-9-26-20/h1-2,5-10,14H,3-4,12H2
InChIKey VXJUUKXADMTZQM-UHFFFAOYSA-N
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Origin 1H_CB_8313_1314
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/8325182; Labnumber: KR-XG00511
Temperature 297 °C