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1-(3-Chloro-4-methyl-phenyl)-5-cyano-4-methyl-6-oxo-1,6-dihydro-pyridazine-3-carboxylic acid ethyl ester
SpectraBase Compound ID DGKOLRbhy8v
InChI InChI=1S/C16H14ClN3O3/c1-4-23-16(22)14-10(3)12(8-18)15(21)20(19-14)11-6-5-9(2)13(17)7-11/h5-7H,4H2,1-3H3
InChIKey YWEGFRDECWSMHF-UHFFFAOYSA-N
Mol Weight 331.76 g/mol
Molecular Formula C16H14ClN3O3
Exact Mass 331.072369 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CbWeJTAe0aD
Name 1-(3-Chloro-4-methyl-phenyl)-5-cyano-4-methyl-6-oxo-1,6-dihydro-pyridazine-3-carboxylic acid ethyl ester
Alternate Name(s) 1-(3-Chloro-4-methyl-phenyl)-5-cyano-6-keto-4-methyl-pyridazine-3-carboxylic acid ethyl ester 1-(3-Chloro-4-methylphenyl)-5-cyano-4-methyl-6-oxo-3-pyridazinecarboxylic acid ethyl ester Ethyl 1-(3-chloranyl-4-methyl-phenyl)-5-cyano-4-methyl-6-oxidanylidene-pyridazine-3-carboxylate Ethyl 1-(3-chloro-4-methyl-phenyl)-5-cyano-4-methyl-6-oxo-pyridazine-3-carboxylate
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Formula C16H14ClN3O3
InChI InChI=1S/C16H14ClN3O3/c1-4-23-16(22)14-10(3)12(8-18)15(21)20(19-14)11-6-5-9(2)13(17)7-11/h5-7H,4H2,1-3H3
InChIKey YWEGFRDECWSMHF-UHFFFAOYSA-N
Molecular Weight 331.759 g/mol
SMILES C=1(C(N(N=C(C1C)C(=O)OCC)c1cc(Cl)c(cc1)C)=O)C#N
SPLASH splash10-0059-6922000000-3170a92839aadb0d7bd8
Wiley ID 1511836