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Diethyl (1R,3R,3aR,6aS)-5-phenyl-4,6-dioxooctahydropyrrolio[3,4-c]pyrrole-1,3-dicarboxylate

View entire compound with spectra: 1 MS (GC)

Diethyl (1R,3R,3aR,6aS)-5-phenyl-4,6-dioxooctahydropyrrolio[3,4-c]pyrrole-1,3-dicarboxylate
SpectraBase Compound ID KoE0RYm800Y
InChI InChI=1S/C18H20N2O6/c1-3-25-17(23)13-11-12(14(19-13)18(24)26-4-2)16(22)20(15(11)21)10-8-6-5-7-9-10/h5-9,11-14,19H,3-4H2,1-2H3/t11-,12+,13-,14-/m1/s1
InChIKey DXVLYGRVJYFNHR-XJFOESAGSA-N
Mol Weight 360.37 g/mol
Molecular Formula C18H20N2O6
Exact Mass 360.132136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IOXIN6PaXfI
Name Diethyl (1R,3R,3aR,6aS)-5-phenyl-4,6-dioxooctahydropyrrolio[3,4-c]pyrrole-1,3-dicarboxylate
Alternate Name(s) Diethyl (1R,3R,3aS,6aR)-5-phenyl-4,6-dioxooctahydropyrrolio[3,4-c]pyrrole-1,3-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20N2O6
InChI InChI=1S/C18H20N2O6/c1-3-25-17(23)13-11-12(14(19-13)18(24)26-4-2)16(22)20(15(11)21)10-8-6-5-7-9-10/h5-9,11-14,19H,3-4H2,1-2H3/t11-,12+,13-,14-/m1/s1
InChIKey DXVLYGRVJYFNHR-XJFOESAGSA-N
Molecular Weight 360.366 g/mol
SMILES N1[C@]([C@@]2([C@]([C@@]1(C(=O)OCC)[H])(C(N(C2=O)c1ccccc1)=O)[H])[H])(C(=O)OCC)[H]
SPLASH splash10-0006-9011000000-f1e18633b79f3a4530d8
Source of Spectrum SO-0-1294-13
Wiley ID 875024