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(S)-3-METHYL-2-(1,3-DIOXOISOINDOLIN-2-YL)-BUTANOIC-ACID

View entire compound with spectra: 1 NMR

(S)-3-METHYL-2-(1,3-DIOXOISOINDOLIN-2-YL)-BUTANOIC-ACID
SpectraBase Compound ID Dq2c7OqoCOD
InChI InChI=1S/C13H13NO4/c1-7(2)10(13(17)18)14-11(15)8-5-3-4-6-9(8)12(14)16/h3-7,10H,1-2H3,(H,17,18)/t10-/m1/s1
InChIKey UUIPGCXIZVZSEC-SNVBAGLBSA-N
Mol Weight 247.25 g/mol
Molecular Formula C13H13NO4
Exact Mass 247.084458 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LRkGu3yXebB
Name (S)-3-METHYL-2-(1,3-DIOXOISOINDOLIN-2-YL)-BUTANOIC-ACID
Compound Number 2I
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H13NO4
InChI InChI=1S/C13H13NO4/c1-7(2)10(13(17)18)14-11(15)8-5-3-4-6-9(8)12(14)16/h3-7,10H,1-2H3,(H,17,18)/t10-/m1/s1
InChIKey UUIPGCXIZVZSEC-SNVBAGLBSA-N
Literature Reference Author D.M.SHENDAGE,R.FROEHLICH,G.HAUFE
Literature Reference Citation ORG.LETTERS,6,3675(2004)
Literature Reference DOI 10.1021/ol048771l
Molecular Weight 247.251 g/mol
Sample ID 50871
Solvent CDCl3