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Pyrrolo[3,4-c]pyrrole-1-carboxylic acid, octahydro-3-(2-hydroxyphenyl)-4,6-dioxo-5-phenyl-, methyl ester, (1.alpha.,3.alpha.,3a.beta.,6a.beta.)-(.+-.)-
SpectraBase Compound ID 1PRLYklS2Ii
InChI InChI=1S/C20H18N2O5/c1-27-20(26)17-15-14(16(21-17)12-9-5-6-10-13(12)23)18(24)22(19(15)25)11-7-3-2-4-8-11/h2-10,14-17,21,23H,1H3
InChIKey OTWBZANEBIIRCY-UHFFFAOYSA-N
Mol Weight 366.37 g/mol
Molecular Formula C20H18N2O5
Exact Mass 366.121572 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1xDBB8pO47s
Name Pyrrolo[3,4-c]pyrrole-1-carboxylic acid, octahydro-3-(2-hydroxyphenyl)-4,6-dioxo-5-phenyl-, methyl ester, (1.alpha.,3.alpha.,3a.beta.,6a.beta.)-(.+-.)-
CAS Registry Number 113430-13-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H18N2O5
InChI InChI=1S/C20H18N2O5/c1-27-20(26)17-15-14(16(21-17)12-9-5-6-10-13(12)23)18(24)22(19(15)25)11-7-3-2-4-8-11/h2-10,14-17,21,23H,1H3
InChIKey OTWBZANEBIIRCY-UHFFFAOYSA-N
Molecular Weight 366.373 g/mol
SMILES N1C(C2C(C1c1c(cccc1)O)C(N(C2=O)c1ccccc1)=O)C(=O)OC
SPLASH splash10-0006-0902000000-4359dfb7c6c5f0a55696
Source of Spectrum KC-1987-2292-16
Synonyms Methyl 3-(2-hydroxyphenyl)-4,6-dioxo-5-phenyloctahydropyrrolo[3,4-c]pyrrole-1-carboxylate Methyl 4-O-hydroxyphenyl-7-phenyl-6,8-dioxo-3,7-diazabicyclo[3.3.0]octane-2-carboxylate
Wiley ID 1351921