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2-keto-6-methyl-5-(phenylthio)-4-(4-pyridyl)-1H-pyridine-3-carbonitrile
SpectraBase Compound ID Ix59BuQHzdk
InChI InChI=1S/C18H13N3OS/c1-12-17(23-14-5-3-2-4-6-14)16(13-7-9-20-10-8-13)15(11-19)18(22)21-12/h2-10H,1H3,(H,21,22)
InChIKey KRCYPNVKSHMHPJ-UHFFFAOYSA-N
Mol Weight 319.38 g/mol
Molecular Formula C18H13N3OS
Exact Mass 319.077933 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8KnRDLaAJav
Name 2-keto-6-methyl-5-(phenylthio)-4-(4-pyridyl)-1H-pyridine-3-carbonitrile
Compound Number 10D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H13N3OS
InChI InChI=1S/C18H13N3OS/c1-12-17(23-14-5-3-2-4-6-14)16(13-7-9-20-10-8-13)15(11-19)18(22)21-12/h2-10H,1H3,(H,21,22)
InChIKey KRCYPNVKSHMHPJ-UHFFFAOYSA-N
Literature Reference Author K.BOGDANOWICZ-SZWED,A.BUDZOWSKI
Literature Reference Citation MH.CHEM.,130,545(1999)
Literature Reference DOI 10.1007/s007060050212
Molecular Weight 319.381 g/mol
Solvent DMSO-D6