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2H-Isoindole-2-acetic acid, .alpha.-(acetyloxy)-.alpha.-cyano-1,3-dihydro-1,3-dioxo-, methyl ester, (.+-.)-
SpectraBase Compound ID AQW8loff7go
InChI InChI=1S/C14H10N2O6/c1-8(17)22-14(7-15,13(20)21-2)16-11(18)9-5-3-4-6-10(9)12(16)19/h3-6H,1-2H3
InChIKey NSNDANDPAYJJJY-UHFFFAOYSA-N
Mol Weight 302.24 g/mol
Molecular Formula C14H10N2O6
Exact Mass 302.053886 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8zdAgxepjwC
Name 2H-Isoindole-2-acetic acid, .alpha.-(acetyloxy)-.alpha.-cyano-1,3-dihydro-1,3-dioxo-, methyl ester, (.+-.)-
Alternate Name(s) Methyl (acetyloxy)(cyano)(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate Methyl 2-acetoxy-2-cyano-phthalimido-ethanoate
CAS Registry Number 130892-59-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H10N2O6
InChI InChI=1S/C14H10N2O6/c1-8(17)22-14(7-15,13(20)21-2)16-11(18)9-5-3-4-6-10(9)12(16)19/h3-6H,1-2H3
InChIKey NSNDANDPAYJJJY-UHFFFAOYSA-N
Molecular Weight 302.242 g/mol
SMILES C(N1C(c2ccccc2C1=O)=O)(OC(=O)C)(C(=O)OC)C#N
SPLASH splash10-0006-9120000000-aadcba5cce10431486f8
Source of Spectrum F-46-5270-16
Wiley ID 1304319