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Pyrrolo[3,4-c]pyrrole-3a(1H)-carboxylic acid, hexahydro-1,4-dioxo-2,5-bis(phenylmethyl)-
SpectraBase Compound ID 5aEdT1YMjtn
InChI InChI=1S/C21H20N2O4/c24-18-17-13-22(11-15-7-3-1-4-8-15)19(25)21(17,20(26)27)14-23(18)12-16-9-5-2-6-10-16/h1-10,17H,11-14H2,(H,26,27)
InChIKey XLXMFYQOXPJSMR-UHFFFAOYSA-N
Mol Weight 364.4 g/mol
Molecular Formula C21H20N2O4
Exact Mass 364.142307 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5j1B09XrvPT
Name Pyrrolo[3,4-c]pyrrole-3a(1H)-carboxylic acid, hexahydro-1,4-dioxo-2,5-bis(phenylmethyl)-
CAS Registry Number 99121-65-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20N2O4
InChI InChI=1S/C21H20N2O4/c24-18-17-13-22(11-15-7-3-1-4-8-15)19(25)21(17,20(26)27)14-23(18)12-16-9-5-2-6-10-16/h1-10,17H,11-14H2,(H,26,27)
InChIKey XLXMFYQOXPJSMR-UHFFFAOYSA-N
Molecular Weight 364.401 g/mol
SMILES OC(C12C(C(=O)N(C2)Cc2ccccc2)CN(C1=O)Cc1ccccc1)=O
SPLASH splash10-0006-9005000000-233e8013c6de0a4da29c
Source of Spectrum H-68-611-2
Synonyms 2,5-Dibenzyl-1,4-dioxo-octahydropyrrolo[3,4-c]pyrrole-3a-carboxylic acid 2,5-Dibenzyl-1,4-dioxohexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxylic acid
Wiley ID 1350855