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3-pyridinecarbonitrile, 5-acetyl-2-[[(2-fluorophenyl)methyl]thio]-6-methyl-
SpectraBase Compound ID 9fcXPdWzMJC
InChI InChI=1S/C16H13FN2OS/c1-10-14(11(2)20)7-13(8-18)16(19-10)21-9-12-5-3-4-6-15(12)17/h3-7H,9H2,1-2H3
InChIKey ZKGOGEQMPYIBGT-UHFFFAOYSA-N
Mol Weight 300.35 g/mol
Molecular Formula C16H13FN2OS
Exact Mass 300.073262 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JaakWTVDndC
Name 3-pyridinecarbonitrile, 5-acetyl-2-[[(2-fluorophenyl)methyl]thio]-6-methyl-
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/C16H13FN2OS/c1-10-14(11(2)20)7-13(8-18)16(19-10)21-9-12-5-3-4-6-15(12)17/h3-7H,9H2,1-2H3
InChIKey ZKGOGEQMPYIBGT-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_8516_4011
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: 63TSH6.005; IOH_ID: IOH-011014