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2-(isobutylthio)-4,5,6-trimethyl-nicotinonitrile
SpectraBase Compound ID E2Tx5uw8P3K
InChI InChI=1S/C13H18N2S/c1-8(2)7-16-13-12(6-14)10(4)9(3)11(5)15-13/h8H,7H2,1-5H3
InChIKey NFJMYJJOUUHAHL-UHFFFAOYSA-N
Mol Weight 234.36 g/mol
Molecular Formula C13H18N2S
Exact Mass 234.11907 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HcQSyZP47or
Name 2-(isobutylthio)-4,5,6-trimethyl-nicotinonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18N2S
InChI InChI=1S/C13H18N2S/c1-8(2)7-16-13-12(6-14)10(4)9(3)11(5)15-13/h8H,7H2,1-5H3
InChIKey NFJMYJJOUUHAHL-UHFFFAOYSA-N
Molecular Weight 234.361 g/mol
SMILES c1(c(nc(c(c1C)C)C)SCC(C)C)C#N
SPLASH splash10-002f-0920000000-c61151cd5d994f427141
Synonyms 2-isobutylsulfanyl-4,5,6-trimethyl-pyridine-3-carbonitrile 4,5,6-trimethyl-2-(2-methylpropylsulfanyl)pyridine-3-carbonitrile 4,5,6-trimethyl-2-(2-methylpropylthio)-3-pyridinecarbonitrile
Wiley ID 1466578