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2-(3-ketoisoindolin-1-yl)acrylic acid methyl ester
SpectraBase Compound ID Gbq13TJzWVm
InChI InChI=1S/C12H11NO3/c1-7(12(15)16-2)10-8-5-3-4-6-9(8)11(14)13-10/h3-6,10H,1H2,2H3,(H,13,14)
InChIKey DWVKYRGKZMDKIM-UHFFFAOYSA-N
Mol Weight 217.22 g/mol
Molecular Formula C12H11NO3
Exact Mass 217.073893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E8ucCTueLGW
Name 2-(3-ketoisoindolin-1-yl)acrylic acid methyl ester
Alternate Name(s) 2-(3-oxo-1,2-dihydroisoindol-1-yl)-2-propenoic acid methyl ester Methyl 2-(3-oxidanylidene-1,2-dihydroisoindol-1-yl)prop-2-enoate Methyl 2-(3-oxo-1,2-dihydroisoindol-1-yl)prop-2-enoate Methyl 2-(3-oxoisoindolin-1-yl)prop-2-enoate
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Formula C12H11NO3
InChI InChI=1S/C12H11NO3/c1-7(12(15)16-2)10-8-5-3-4-6-9(8)11(14)13-10/h3-6,10H,1H2,2H3,(H,13,14)
InChIKey DWVKYRGKZMDKIM-UHFFFAOYSA-N
Molecular Weight 217.224 g/mol
SMILES N1C(c2c(C1C(C(=O)OC)=C)cccc2)=O
SPLASH splash10-053i-0900000000-00de2ccb95636a6a6e6a
Source of Spectrum Y-40-940-5
Wiley ID 1567263