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8-(Dicyanomethylene)-5-(thioxo)-4,6-dithiatetracyclo[7.5.0.0(3,7).2(10,13)]pentadecadiene-2-one
SpectraBase Compound ID U7kua1zb9H
InChI InChI=1S/C16H10N2OS3/c17-5-9(6-18)12-10-7-1-3-8(4-2-7)11(10)13(19)15-14(12)21-16(20)22-15/h1,3,7-8,10-11H,2,4H2
InChIKey PQORMYCPFGJSDI-UHFFFAOYSA-N
Mol Weight 342.45 g/mol
Molecular Formula C16H10N2OS3
Exact Mass 341.995526 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 25wiWxiAAKK
Name 8-(Dicyanomethylene)-5-(thioxo)-4,6-dithiatetracyclo[7.5.0.0(3,7).2(10,13)]pentadecadiene-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H10N2OS3
InChI InChI=1S/C16H10N2OS3/c17-5-9(6-18)12-10-7-1-3-8(4-2-7)11(10)13(19)15-14(12)21-16(20)22-15/h1,3,7-8,10-11H,2,4H2
InChIKey PQORMYCPFGJSDI-UHFFFAOYSA-N
Molecular Weight 342.449 g/mol
SMILES C12=C(C(=C(C#N)C#N)C3C(C2=O)C2C=CC3CC2)SC(S1)=S
SPLASH splash10-03dl-0009000000-e5ca7a21b63bf81d3e4e
Source of Spectrum U1-2009-6351-31
Wiley ID 1663258