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DIMETHYL-2-[(3-OXO-3H-ISOINDOL-1-YL)-OXY]-MALONATE
SpectraBase Compound ID D5xhTbaOQsi
InChI InChI=1S/C13H11NO6/c1-18-12(16)9(13(17)19-2)20-11-8-6-4-3-5-7(8)10(15)14-11/h3-6,9H,1-2H3
InChIKey MTGFMLMHMQCCDB-UHFFFAOYSA-N
Mol Weight 277.23 g/mol
Molecular Formula C13H11NO6
Exact Mass 277.058637 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID kRFYVve8NL
Name 2-(3-ketoisoindol-1-yl)oxymalonic acid dimethyl ester
Alternate Name(s) 2-[(3-oxo-1-isoindolyl)oxy]propanedioic acid dimethyl ester Dimethyl 2-(3-oxidanylideneisoindol-1-yl)oxypropanedioate Dimethyl 2-(3-oxoisoindol-1-yl)oxypropanedioate
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Formula C13H11NO6
InChI InChI=1S/C13H11NO6/c1-18-12(16)9(13(17)19-2)20-11-8-6-4-3-5-7(8)10(15)14-11/h3-6,9H,1-2H3
InChIKey MTGFMLMHMQCCDB-UHFFFAOYSA-N
Molecular Weight 277.232 g/mol
SMILES C(C(C(=O)OC)OC1=NC(c2ccccc12)=O)(=O)OC
SPLASH splash10-02ji-4940000000-8031d0f7da5478c4ccd6
Source of Spectrum K1-0-4743-3
Wiley ID 1589638