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GRABJGORIUICFO-QDNSGRMVSA-N
SpectraBase Compound ID 3CK8lEMz5EZ
InChI InChI=1S/C34H28N2O5/c1-40-26-18-24-25(19-27(26)41-2)34(22-14-8-4-9-15-22)29-28(30(37)36(31(29)38)23-16-10-5-11-17-23)33(24,32(39)35-34)20-21-12-6-3-7-13-21/h3-19,28-29H,20H2,1-2H3,(H,35,39)/t28?,29?,33-,34+/m1/s1
InChIKey GRABJGORIUICFO-QDNSGRMVSA-N
Mol Weight 544.6 g/mol
Molecular Formula C34H28N2O5
Exact Mass 544.199822 g/mol
Enantiomer InChIKey GRABJGORIUICFO-NGBXVECZSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Title Journal or Book Year
1H and 13C nuclear magnetic resonance studies on the Diels–Alder adducts of isoquinolin-3(2H)-ones Canadian Journal of Chemistry 1985

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