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4-[5-(4-cyanobenzoyl)-1,2,4-thiadiazole-3-carbonyl]benzonitrile
SpectraBase Compound ID FYvn9y2GzX3
InChI InChI=1S/C18H8N4O2S/c19-9-11-1-5-13(6-2-11)15(23)17-21-18(25-22-17)16(24)14-7-3-12(10-20)4-8-14/h1-8H
InChIKey JBVYRUBPOMZXHY-UHFFFAOYSA-N
Mol Weight 344.35 g/mol
Molecular Formula C18H8N4O2S
Exact Mass 344.036797 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LKZDTCz0Pnc
Name 4-[5-(4-cyanobenzoyl)-1,2,4-thiadiazole-3-carbonyl]benzonitrile
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Formula C18H8N4O2S
InChI InChI=1S/C18H8N4O2S/c19-9-11-1-5-13(6-2-11)15(23)17-21-18(25-22-17)16(24)14-7-3-12(10-20)4-8-14/h1-8H
InChIKey JBVYRUBPOMZXHY-UHFFFAOYSA-N
Molecular Weight 344.348 g/mol
SMILES c1(nsc(n1)C(c1ccc(cc1)C#N)=O)C(c1ccc(cc1)C#N)=O
SPLASH splash10-000x-9700000000-f826121f64b6383e0678
Source of Spectrum KC-0-257-2
Synonyms 4-[[5-(4-cyanophenyl)carbonyl-1,2,4-thiadiazol-3-yl]carbonyl]benzenecarbonitrile 4-[[5-[(4-cyanophenyl)-oxomethyl]-1,2,4-thiadiazol-3-yl]-oxomethyl]benzonitrile
Wiley ID 783011