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2-(1,3-dimethyl-2,4-dioxo-5H-pteridin-6-ylidene)propanedinitrile
SpectraBase Compound ID D3ILDmAOSlo
InChI InChI=1S/C11H8N6O2/c1-16-9-8(10(18)17(2)11(16)19)15-7(5-14-9)6(3-12)4-13/h5,15H,1-2H3
InChIKey SHMHMQAYONFJMB-UHFFFAOYSA-N
Mol Weight 256.22 g/mol
Molecular Formula C11H8N6O2
Exact Mass 256.070874 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IqChS2oBNqB
Name 2-(1,3-dimethyl-2,4-dioxo-5H-pteridin-6-ylidene)propanedinitrile
Alternate Name(s) 2-(2,4-diketo-1,3-dimethyl-5H-pteridin-6-ylidene)malononitrile 2-[1,3-dimethyl-2,4-bis(oxidanylidene)-5H-pteridin-6-ylidene]propanedinitrile
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Formula C11H8N6O2
InChI InChI=1S/C11H8N6O2/c1-16-9-8(10(18)17(2)11(16)19)15-7(5-14-9)6(3-12)4-13/h5,15H,1-2H3
InChIKey SHMHMQAYONFJMB-UHFFFAOYSA-N
Molecular Weight 256.225 g/mol
SMILES N1C(C=NC2=C1C(N(C(N2C)=O)C)=O)=C(C#N)C#N
SPLASH splash10-0a4i-0490000000-db5c532801c7c2db3b60
Source of Spectrum O1-32-439-7
Wiley ID 819011