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Pyrrolo[3,4-c]pyrrole-1,1(2H)-dicarboxylic acid, hexahydro-3-(4-methoxyphenyl)-4,6-dioxo-5-phenyl-, diethyl ester, (3.alpha.,3a.beta.,6a.beta.)-
SpectraBase Compound ID 4aXAdnzCFG0
InChI InChI=1S/C25H26N2O7/c1-4-33-23(30)25(24(31)34-5-2)19-18(20(26-25)15-11-13-17(32-3)14-12-15)21(28)27(22(19)29)16-9-7-6-8-10-16/h6-14,18-20,26H,4-5H2,1-3H3
InChIKey HEPLNVFKLOQNPJ-UHFFFAOYSA-N
Mol Weight 466.49 g/mol
Molecular Formula C25H26N2O7
Exact Mass 466.174001 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4XCL6tQk3cv
Name Pyrrolo[3,4-c]pyrrole-1,1(2H)-dicarboxylic acid, hexahydro-3-(4-methoxyphenyl)-4,6-dioxo-5-phenyl-, diethyl ester, (3.alpha.,3a.beta.,6a.beta.)-
CAS Registry Number 125660-70-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H26N2O7
InChI InChI=1S/C25H26N2O7/c1-4-33-23(30)25(24(31)34-5-2)19-18(20(26-25)15-11-13-17(32-3)14-12-15)21(28)27(22(19)29)16-9-7-6-8-10-16/h6-14,18-20,26H,4-5H2,1-3H3
InChIKey HEPLNVFKLOQNPJ-UHFFFAOYSA-N
Molecular Weight 466.490 g/mol
SMILES N1C(C2C(C1(C(=O)OCC)C(=O)OCC)C(N(C2=O)c1ccccc1)=O)c1ccc(cc1)OC
SPLASH splash10-0006-0196100000-2e702d4509a8ff11509e
Source of Spectrum F-45-4665-25
Synonyms Diethyl 3-(4-methoxyphenyl)-4,6-dioxo-5-phenylhexahydropyrrolo[3,4-c]pyrrole-1,1(2H)-dicarboxylate Diethyl 4-(4'-methoxyphenyl)-7-phenyl-6,8-dioxo-3,7-diazabicyclo[3.3.0]octane-2,2-dicarboxylate
Wiley ID 1391931