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2-cyano-2-(1,3-dioxo-2-isoindolyl)acetic acid
SpectraBase Compound ID 6zfxwMkUu5c
InChI InChI=1S/C11H6N2O4/c12-5-8(11(16)17)13-9(14)6-3-1-2-4-7(6)10(13)15/h1-4,8H,(H,16,17)
InChIKey CSXRISGYBVCIGG-UHFFFAOYSA-N
Mol Weight 230.18 g/mol
Molecular Formula C11H6N2O4
Exact Mass 230.032757 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IjcX2cPWUM1
Name 2-cyano-2-(1,3-dioxo-2-isoindolyl)acetic acid
Alternate Name(s) 2-cyano-2-(1,3-dioxoisoindol-2-yl)acetic acid 2-cyano-2-(1,3-dioxoisoindolin-2-yl)acetic acid 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-cyano-ethanoic acid
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Formula C11H6N2O4
InChI InChI=1S/C11H6N2O4/c12-5-8(11(16)17)13-9(14)6-3-1-2-4-7(6)10(13)15/h1-4,8H,(H,16,17)
InChIKey CSXRISGYBVCIGG-UHFFFAOYSA-N
Molecular Weight 230.179 g/mol
SMILES OC(C(N1C(c2ccccc2C1=O)=O)C#N)=O
SPLASH splash10-0fa6-5900000000-ba817cb32d3e62072343
Source of Spectrum QC-1-616-2
Wiley ID 882913