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4-(4-Methoxyphenyl)-6-methyl-2-[(3-pyridinylmethyl)sulfanyl]nicotinonitrile
SpectraBase Compound ID KrtQrR9UdCk
InChI InChI=1S/C20H17N3OS/c1-14-10-18(16-5-7-17(24-2)8-6-16)19(11-21)20(23-14)25-13-15-4-3-9-22-12-15/h3-10,12H,13H2,1-2H3
InChIKey RAJQQHPTDVGAHO-UHFFFAOYSA-N
Mol Weight 347.44 g/mol
Molecular Formula C20H17N3OS
Exact Mass 347.109233 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fsnxbphahhn
Name 4-(4-Methoxyphenyl)-6-methyl-2-[(3-pyridinylmethyl)sulfanyl]nicotinonitrile
CAS Registry Number 311763-29-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H17N3OS
InChI InChI=1S/C20H17N3OS/c1-14-10-18(16-5-7-17(24-2)8-6-16)19(11-21)20(23-14)25-13-15-4-3-9-22-12-15/h3-10,12H,13H2,1-2H3
InChIKey RAJQQHPTDVGAHO-UHFFFAOYSA-N
Molecular Weight 347.436 g/mol
SMILES c1(c(nc(cc1-c1ccc(cc1)OC)C)SCc1cnccc1)C#N
SPLASH splash10-00di-4903000000-5e91c2677c2e32f0119a
Source of Spectrum AD-0-2532-0
Synonyms 4-(4-Methoxyphenyl)-6-methyl-2-(3-pyridinylmethylthio)-3-pyridinecarbonitrile 4-(4-Methoxyphenyl)-6-methyl-2-(3-pyridylmethylsulfanyl)pyridine-3-carbonitrile 4-(4-Methoxyphenyl)-6-methyl-2-(3-pyridylmethylthio)nicotinonitrile 4-(4-Methoxyphenyl)-6-methyl-2-(pyridin-3-ylmethylsulfanyl)pyridine-3-carbonitrile Pyridine-3-carbonitrile, 4-(4-methoxyphenyl)-6-methyl-2-(3-pyridylmethylthio)-
Wiley ID 1430701