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2,5-Dianilino-3,6-diketo-cyclohexa-1,4-diene-1-carboxylic acid ethyl ester
SpectraBase Compound ID 27p9uYbcK0N
InChI InChI=1S/C21H18N2O4/c1-2-27-21(26)18-19(23-15-11-7-4-8-12-15)17(24)13-16(20(18)25)22-14-9-5-3-6-10-14/h3-13,22-23H,2H2,1H3
InChIKey ZXEBQKOBZKORPW-UHFFFAOYSA-N
Mol Weight 362.39 g/mol
Molecular Formula C21H18N2O4
Exact Mass 362.126657 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1wmCU9FVDO
Name 2,5-Dianilino-3,6-diketo-cyclohexa-1,4-diene-1-carboxylic acid ethyl ester
CAS Registry Number 101130-38-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H18N2O4
InChI InChI=1S/C21H18N2O4/c1-2-27-21(26)18-19(23-15-11-7-4-8-12-15)17(24)13-16(20(18)25)22-14-9-5-3-6-10-14/h3-13,22-23H,2H2,1H3
InChIKey ZXEBQKOBZKORPW-UHFFFAOYSA-N
Molecular Weight 362.385 g/mol
SMILES N(C=1C(C(=C(C(C1)=O)Nc1ccccc1)C(=O)OCC)=O)c1ccccc1
SPLASH splash10-029l-0469000000-5b2052dee62704a5a313
Source of Spectrum Y-22-698-2
Synonyms 2,5-Dianilino-3,6-dioxo-1-cyclohexa-1,4-dienecarboxylic acid ethyl ester Ethyl 2,5-dianilino-3,6-dioxo-cyclohexa-1,4-diene-1-carboxylate Ethyl 3,6-bis(oxidanylidene)-2,5-bis(phenylazanyl)cyclohexa-1,4-diene-1-carboxylate
Wiley ID 1349682