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2-(1,3-dioxo-2-isoindolyl)-3-oxobutanoic acid methyl ester
SpectraBase Compound ID 3hxHOTs5vCM
InChI InChI=1S/C13H11NO5/c1-7(15)10(13(18)19-2)14-11(16)8-5-3-4-6-9(8)12(14)17/h3-6,10H,1-2H3
InChIKey OWTDSHMCGTWUHT-UHFFFAOYSA-N
Mol Weight 261.23 g/mol
Molecular Formula C13H11NO5
Exact Mass 261.063722 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1qep4nYrKlc
Name 2-(1,3-dioxo-2-isoindolyl)-3-oxobutanoic acid methyl ester
Alternate Name(s) 3-keto-2-phthalimido-butyric acid methyl ester Methyl 2-(1,3-dioxoisoindol-2-yl)-3-oxobutanoate Methyl 2-(1,3-dioxoisoindolin-2-yl)-3-oxo-butanoate Methyl 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-oxidanylidene-butanoate
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Formula C13H11NO5
InChI InChI=1S/C13H11NO5/c1-7(15)10(13(18)19-2)14-11(16)8-5-3-4-6-9(8)12(14)17/h3-6,10H,1-2H3
InChIKey OWTDSHMCGTWUHT-UHFFFAOYSA-N
Molecular Weight 261.233 g/mol
SMILES C1(N(C(c2ccccc12)=O)C(C(=O)OC)C(=O)C)=O
SPLASH splash10-001i-0970000000-1f6a2994cbd28b1fb6c3
Source of Spectrum KC-0-764-10
Wiley ID 787583