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(4E)-4-(2,4-dichlorobenzylidene)-1-(p-tolyl)pyrazolidine-3,5-quinone
SpectraBase Compound ID DxJJ8aeliXg
InChI InChI=1S/C17H12Cl2N2O2/c1-10-2-6-13(7-3-10)21-17(23)14(16(22)20-21)8-11-4-5-12(18)9-15(11)19/h2-9H,1H3,(H,20,22)/b14-8+
InChIKey KHTPXQMATLGAKM-RIYZIHGNSA-N
Mol Weight 347.2 g/mol
Molecular Formula C17H12Cl2N2O2
Exact Mass 346.027583 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CfEkR4ZNWVN
Name (4E)-4-(2,4-dichlorobenzylidene)-1-(p-tolyl)pyrazolidine-3,5-quinone
Alternate Name(s) (4E)-4-[(2,4-dichlorophenyl)methylene]-1-(p-tolyl)pyrazolidine-3,5-dione (4E)-4-[(2,4-dichlorophenyl)methylidene]-1-(4-methylphenyl)pyrazolidine-3,5-dione
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Formula C17H12Cl2N2O2
InChI InChI=1S/C17H12Cl2N2O2/c1-10-2-6-13(7-3-10)21-17(23)14(16(22)20-21)8-11-4-5-12(18)9-15(11)19/h2-9H,1H3,(H,20,22)/b14-8+
InChIKey KHTPXQMATLGAKM-RIYZIHGNSA-N
Molecular Weight 347.201 g/mol
SMILES N1N(C(\C(C1=O)=C/c1c(cc(cc1)Cl)Cl)=O)c1ccc(cc1)C
SPLASH splash10-01oy-9403000000-a5f26a47da8c4d21b4a0
Wiley ID 1451775