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4-Amino-5-cyano-2-methyl-6-(4-methylphenoxy)-nicotinic acid ethyl ester
SpectraBase Compound ID JOiMmqqLVZr
InChI InChI=1S/C17H17N3O3/c1-4-22-17(21)14-11(3)20-16(13(9-18)15(14)19)23-12-7-5-10(2)6-8-12/h5-8H,4H2,1-3H3,(H2,19,20)
InChIKey JRDAPYOKOKXUFM-UHFFFAOYSA-N
Mol Weight 311.34 g/mol
Molecular Formula C17H17N3O3
Exact Mass 311.126991 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3yUUq2cuZoA
Name 4-Amino-5-cyano-2-methyl-6-(4-methylphenoxy)-nicotinic acid ethyl ester
Alternate Name(s) 4-Amino-5-cyano-2-methyl-6-(4-methylphenoxy)-3-pyridinecarboxylic acid ethyl ester Ethyl 4-amino-5-cyano-2-methyl-6-(4-methylphenoxy)pyridine-3-carboxylate Ethyl 4-azanyl-5-cyano-2-methyl-6-(4-methylphenoxy)pyridine-3-carboxylate
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Formula C17H17N3O3
InChI InChI=1S/C17H17N3O3/c1-4-22-17(21)14-11(3)20-16(13(9-18)15(14)19)23-12-7-5-10(2)6-8-12/h5-8H,4H2,1-3H3,(H2,19,20)
InChIKey JRDAPYOKOKXUFM-UHFFFAOYSA-N
Molecular Weight 311.341 g/mol
SMILES Nc1c(c(C)nc(c1C#N)Oc1ccc(cc1)C)C(=O)OCC
SPLASH splash10-01p9-1195000000-1b5a6bfcc0f107f06250
Source of Spectrum Y-47-177-8j
Wiley ID 1667027