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thiobenzoic acid S-[4-(1,3-diketoisoindolin-2-yl)-3-keto-butyl] ester
SpectraBase Compound ID 7RNmVTFvJcg
InChI InChI=1S/C19H15NO4S/c21-14(10-11-25-19(24)13-6-2-1-3-7-13)12-20-17(22)15-8-4-5-9-16(15)18(20)23/h1-9H,10-12H2
InChIKey LMBVKPHUNXZZDQ-UHFFFAOYSA-N
Mol Weight 353.39 g/mol
Molecular Formula C19H15NO4S
Exact Mass 353.072179 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5b28M4UgonN
Name thiobenzoic acid S-[4-(1,3-diketoisoindolin-2-yl)-3-keto-butyl] ester
Compound Number 21A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H15NO4S
InChI InChI=1S/C19H15NO4S/c21-14(10-11-25-19(24)13-6-2-1-3-7-13)12-20-17(22)15-8-4-5-9-16(15)18(20)23/h1-9H,10-12H2
InChIKey LMBVKPHUNXZZDQ-UHFFFAOYSA-N
Literature Reference Author R.M.LUEOEND,J.WALKER,R.W.NEIER
Literature Reference Citation J.ORG.CHEM.,57,5005(1992)
Literature Reference DOI 10.1021/jo00044a041
Molecular Weight 353.392 g/mol
Solvent CDCl3
Source File Reference UWCS1270