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Methyl (1S*,3R*,3aS*,6aR*)-3-benzoyl-1,5-dimethyl-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylate
SpectraBase Compound ID A6ovnPDTprA
InChI InChI=1S/C17H18N2O5/c1-17(16(23)24-3)11-10(14(21)19(2)15(11)22)12(18-17)13(20)9-7-5-4-6-8-9/h4-8,10-12,18H,1-3H3/t10-,11-,12+,17-/m0/s1
InChIKey GCPLQQAEADXQMZ-PXDYOCJYSA-N
Mol Weight 330.34 g/mol
Molecular Formula C17H18N2O5
Exact Mass 330.121572 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3CWZSjFXvM
Name Methyl (1S*,3R*,3aS*,6aR*)-3-benzoyl-1,5-dimethyl-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylate
Alternate Name(s) Methyl (1S,3R,3aS,6aR)-3-benzoyl-1,5-dimethyl-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18N2O5
InChI InChI=1S/C17H18N2O5/c1-17(16(23)24-3)11-10(14(21)19(2)15(11)22)12(18-17)13(20)9-7-5-4-6-8-9/h4-8,10-12,18H,1-3H3/t10-,11-,12+,17-/m0/s1
InChIKey GCPLQQAEADXQMZ-PXDYOCJYSA-N
Literature Reference DOI 10.1016/j.tet.2015.09.039
Molecular Weight 330.340 g/mol
SMILES N1[C@@]([C@]2([C@@]([C@@]1(C(=O)c1ccccc1)[H])(C(N(C2=O)C)=O)[H])[H])(C(=O)OC)C
SPLASH splash10-05r0-3950000000-c35beda49a08f8f603d2
Source of Spectrum F-71-8815-endo_cis_10a
Wiley ID 1803213