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2-Methyl-5-(trideuterio)methyl-N,N'-dicyano-1,4-benzoquinone - diimine
SpectraBase Compound ID DntEVbwkD1g
InChI InChI=1S/C10H8N4/c1-7-3-10(14-6-12)8(2)4-9(7)13-5-11/h3-4H,1-2H3/b13-9-,14-10-/i1D3
InChIKey GJCNOUWCQVLIEI-NGHOABAISA-N
Mol Weight 187.22 g/mol
Molecular Formula C10H52D3N4
Exact Mass 187.093727 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LqDQs7UDe7Y
Name 2-Methyl-5-(trideuterio)methyl-N,N'-dicyano-1,4-benzoquinone - diimine
Comments Less than 3 mono-isotopic peaks
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Formula C10H5D3N4
InChI InChI=1S/C10H8N4/c1-7-3-10(14-6-12)8(2)4-9(7)13-5-11/h3-4H,1-2H3/b13-9-,14-10-/i1D3
InChIKey GJCNOUWCQVLIEI-NGHOABAISA-N
Molecular Weight 187.220 g/mol
SMILES C=1\C(C(C([2D])([2D])[2D])=C\C(C1C)=N\C#N)=N\C#N
SPLASH splash10-000i-0900000000-0e83cc551396be23bd13
Source of Spectrum U1-1998-347-2
Wiley ID 750917