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1,4,2-Dithiazole, propanedinitrile deriv.
SpectraBase Compound ID I7XAMIC5fh3
InChI InChI=1S/C11H5N3S2/c12-6-9(7-13)11-15-10(14-16-11)8-4-2-1-3-5-8/h1-5H
InChIKey SPRMXYKORNMHKA-UHFFFAOYSA-N
Mol Weight 243.3 g/mol
Molecular Formula C11H5N3S2
Exact Mass 242.99249 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9myJyOZDCn
Name 1,4,2-Dithiazole, propanedinitrile deriv.
CAS Registry Number 122583-24-8
Comments Less than 3 mono-isotopic peaks
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Formula C11H5N3S2
InChI InChI=1S/C11H5N3S2/c12-6-9(7-13)11-15-10(14-16-11)8-4-2-1-3-5-8/h1-5H
InChIKey SPRMXYKORNMHKA-UHFFFAOYSA-N
Molecular Weight 243.302 g/mol
SMILES C1(SC(c2ccccc2)=NS1)=C(C#N)C#N
SPLASH splash10-0udi-0930000000-573080bcb4917c363936
Source of Spectrum AJ-62-1090-5
Synonyms Propanedinitrile, (3-phenyl-1,4,2-dithiazol-5-ylidene)- 2-(3-phenyl-1,4,2-dithiazol-5-ylidene)malononitrile 5-Dicyanomethylene-3-phenyl-1,4,2-dithiazole
Wiley ID 1245867