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Methyl (1S*,3R*,3aS*,6aR*)-3-benzoyl-4,6-dioxo-5-phenyloctahydropyrrolo[3,4-c]pyrrole-1-carboxylate
SpectraBase Compound ID DFvAhHrjw6Y
InChI InChI=1S/C21H18N2O5/c1-28-21(27)17-15-14(16(22-17)18(24)12-8-4-2-5-9-12)19(25)23(20(15)26)13-10-6-3-7-11-13/h2-11,14-17,22H,1H3/t14-,15+,16+,17-/m0/s1
InChIKey FJCVEVDEUDVMNO-HZMVEIRTSA-N
Mol Weight 378.38 g/mol
Molecular Formula C21H18N2O5
Exact Mass 378.121572 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 24WmybFl2zk
Name Methyl (1S*,3R*,3aS*,6aR*)-3-benzoyl-4,6-dioxo-5-phenyloctahydropyrrolo[3,4-c]pyrrole-1-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H18N2O5
InChI InChI=1S/C21H18N2O5/c1-28-21(27)17-15-14(16(22-17)18(24)12-8-4-2-5-9-12)19(25)23(20(15)26)13-10-6-3-7-11-13/h2-11,14-17,22H,1H3/t14-,15+,16+,17-/m0/s1
InChIKey FJCVEVDEUDVMNO-HZMVEIRTSA-N
Literature Reference DOI 10.1016/j.tet.2015.09.039
Molecular Weight 378.384 g/mol
SMILES N1[C@@]([C@]2([C@@]([C@@]1(C(=O)c1ccccc1)[H])(C(N(C2=O)c1ccccc1)=O)[H])[H])(C(=O)OC)[H]
SPLASH splash10-00dl-6290000000-4d8b8b6004d38fda49b5
Source of Spectrum F-71-8815-endo_cis_9c
Synonyms Methyl (1S,3R,3aS,6aR)-3-benzoyl-4,6-dioxo-5-phenyloctahydropyrrolo[3,4-c]pyrrole-1-carboxylate
Wiley ID 1803243