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5,6-Dicyano-1(3H)-isobenzofuranone
SpectraBase Compound ID 6NyPRmPRb5E
InChI InChI=1S/C10H4N2O2/c11-3-6-1-8-5-14-10(13)9(8)2-7(6)4-12/h1-2H,5H2
InChIKey BYBIBGHPQLJKHW-UHFFFAOYSA-N
Mol Weight 184.15 g/mol
Molecular Formula C10H4N2O2
Exact Mass 184.027277 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CsyjGPLcpO0
Name 5,6-Dicyano-1(3H)-isobenzofuranone
Comments Less than 3 mono-isotopic peaks
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Formula C10H4N2O2
InChI InChI=1S/C10H4N2O2/c11-3-6-1-8-5-14-10(13)9(8)2-7(6)4-12/h1-2H,5H2
InChIKey BYBIBGHPQLJKHW-UHFFFAOYSA-N
Molecular Weight 184.154 g/mol
SMILES c12C(OCc2cc(c(c1)C#N)C#N)=O
SPLASH splash10-0a4i-0900000000-426b96edb04eb4a27f07
Source of Spectrum F-52-1794-5
Synonyms 1-oxo-1,3-dihydro-2-benzofuran-5,6-dicarbonitrile 3-oxo-1H-2-benzofuran-5,6-dicarbonitrile 3-oxo-1H-isobenzofuran-5,6-dicarbonitrile 3-oxidanylidene-1H-2-benzofuran-5,6-dicarbonitrile
Wiley ID 795216