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2-(1,3-dioxo-2-isoindolyl)propanenitrile
SpectraBase Compound ID qI5Cwhyifs
InChI InChI=1S/C11H8N2O2/c1-7(6-12)13-10(14)8-4-2-3-5-9(8)11(13)15/h2-5,7H,1H3
InChIKey CCMYZTUSYFAWOI-UHFFFAOYSA-N
Mol Weight 200.2 g/mol
Molecular Formula C11H8N2O2
Exact Mass 200.058578 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4IcUB8eDMMF
Name 2-(1,3-dioxo-2-isoindolyl)propanenitrile
Alternate Name(s) 2-(1,3-dioxoisoindol-2-yl)propanenitrile 2-(1,3-dioxoisoindolin-2-yl)propanenitrile 2-Phthalimidopropionitrile 2-[1,3-bis(oxidanylidene)isoindol-2-yl]propanenitrile
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Formula C11H8N2O2
InChI InChI=1S/C11H8N2O2/c1-7(6-12)13-10(14)8-4-2-3-5-9(8)11(13)15/h2-5,7H,1H3
InChIKey CCMYZTUSYFAWOI-UHFFFAOYSA-N
Molecular Weight 200.197 g/mol
SMILES C1(N(C(c2ccccc12)=O)C(C#N)C)=O
SPLASH splash10-0zg0-1910000000-e93f5de635c77479f823
Source of Spectrum QC-1-616-3
Wiley ID 882912