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3-pyridinecarbonitrile, 6-(4-methoxyphenyl)-2-[(phenylmethyl)thio]-4-(trifluoromethyl)-
SpectraBase Compound ID 8VIttp9xslH
InChI InChI=1S/C21H15F3N2OS/c1-27-16-9-7-15(8-10-16)19-11-18(21(22,23)24)17(12-25)20(26-19)28-13-14-5-3-2-4-6-14/h2-11H,13H2,1H3
InChIKey JSBBYSLNLBNDBY-UHFFFAOYSA-N
Mol Weight 400.42 g/mol
Molecular Formula C21H15F3N2OS
Exact Mass 400.085719 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CYHTnMCdMUR
Name 3-pyridinecarbonitrile, 6-(4-methoxyphenyl)-2-[(phenylmethyl)thio]-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/C21H15F3N2OS/c1-27-16-9-7-15(8-10-16)19-11-18(21(22,23)24)17(12-25)20(26-19)28-13-14-5-3-2-4-6-14/h2-11H,13H2,1H3
InChIKey JSBBYSLNLBNDBY-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_2850
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: F15780; Labnumber: GOR-S1034-0278