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4,6-dimethyl-2-mercaptonicotinonitrile
SpectraBase Compound ID 2G8fv2HAoGY
InChI InChI=1S/C8H8N2S/c1-5-3-6(2)10-8(11)7(5)4-9/h3H,1-2H3,(H,10,11)
InChIKey CZRHEROEPICLRO-UHFFFAOYSA-N
Mol Weight 164.23 g/mol
Molecular Formula C8H8N2S
Exact Mass 164.040819 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B4Cjzlk5bFo
Name 1,2-Dihydro-4,6-dimethyl-2-thioxo-3-pyridinecarbonitrile
CAS Registry Number 54585-47-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H8N2S
InChI InChI=1S/C8H8N2S/c1-5-3-6(2)10-8(11)7(5)4-9/h3H,1-2H3,(H,10,11)
InChIKey CZRHEROEPICLRO-UHFFFAOYSA-N
Molecular Weight 164.226 g/mol
SMILES N1C(C(=C(C=C1C)C)C#N)=S
SPLASH splash10-03xr-2900000000-4055f21b75eddabe29b1
Source of Spectrum AD-0-2532-0
Synonyms 4,6-Dimethyl-2-sulfanylnicotinonitrile 3-Pyridinecarbonitrile, 1,2-dihydro-4,6-dimethyl-2-thioxo- 4,6-Dimethyl-2-mercaptopyridine-3-carbonitrile 4,6-Dimethyl-2-sulfanylidene-1H-pyridine-3-carbonitrile 4,6-Dimethyl-2-thioxo-1,2-dihydro-3-pyridinecarbonitrile 4,6-Dimethyl-2-thioxo-1H-pyridine-3-carbonitrile Pyridine-3-carbonitrile, 1,2-dihydro-4,6-dimethyl-2-thioxo-
Wiley ID 1423219