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3-Cyanomethylthio-4-cyano-5,6-diphenylpyridazine
SpectraBase Compound ID veRzkXofBC
InChI InChI=1S/C19H12N4S/c20-11-12-24-19-16(13-21)17(14-7-3-1-4-8-14)18(22-23-19)15-9-5-2-6-10-15/h1-10H,12H2
InChIKey BEFJTCGGYIDPJA-UHFFFAOYSA-N
Mol Weight 328.39 g/mol
Molecular Formula C19H12N4S
Exact Mass 328.078268 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fynpn5DZE62
Name 3-Cyanomethylthio-4-cyano-5,6-diphenylpyridazine
Comments Less than 3 mono-isotopic peaks
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Formula C19H12N4S
InChI InChI=1S/C19H12N4S/c20-11-12-24-19-16(13-21)17(14-7-3-1-4-8-14)18(22-23-19)15-9-5-2-6-10-15/h1-10H,12H2
InChIKey BEFJTCGGYIDPJA-UHFFFAOYSA-N
Molecular Weight 328.393 g/mol
SMILES c1(c(c(-c2ccccc2)nnc1SCC#N)-c1ccccc1)C#N
SPLASH splash10-004i-0009000000-da1dbce0f5233cf3a422
Source of Spectrum AH-127-742-2
Synonyms 3-[(cyanomethyl)sulfanyl]-5,6-diphenyl-4-pyridazinecarbonitrile 3-(cyanomethylthio)-5,6-diphenyl-4-pyridazinecarbonitrile 3-(cyanomethylsulfanyl)-5,6-diphenylpyridazine-4-carbonitrile 3-(cyanomethylsulfanyl)-5,6-diphenyl-pyridazine-4-carbonitrile
Wiley ID 1326311