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1-ethyl-2-sulfanylidene-3-pyridinecarbonitrile
SpectraBase Compound ID A8bznr1l13h
InChI InChI=1S/C8H8N2S/c1-2-10-5-3-4-7(6-9)8(10)11/h3-5H,2H2,1H3
InChIKey LBKIYPCSSBACRP-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 IXKxqWfa4Zv
Name 1-ethyl-2-sulfanylidene-3-pyridinecarbonitrile
Alternate Name(s) 1-ethyl-2-sulfanylidene-pyridine-3-carbonitrile 1-ethyl-2-thioxo-nicotinonitrile 1-ethyl-2-thioxo-pyridine-3-carbonitrile
CAS Registry Number 91540-51-1
Comments Less than 3 mono-isotopic peaks
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Formula C8H8N2S
InChI InChI=1S/C8H8N2S/c1-2-10-5-3-4-7(6-9)8(10)11/h3-5H,2H2,1H3
InChIKey LBKIYPCSSBACRP-UHFFFAOYSA-N
Molecular Weight 164.226 g/mol
SMILES C1(C(C#N)=CC=CN1CC)=S
SPLASH splash10-01p9-0900000000-5e00574c9078a9e5641b
Source of Spectrum Y-21-44-2
Wiley ID 1160011