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6-cyano-5-keto-7-methyl-2,3-dihydro-1H-imidazo[1,2-a]pyridine-8-carboxylic acid ethyl ester
SpectraBase Compound ID 75941JK3FUk
InChI InChI=1S/C12H13N3O3/c1-3-18-12(17)9-7(2)8(6-13)11(16)15-5-4-14-10(9)15/h14H,3-5H2,1-2H3
InChIKey BXWTUKMAMUHIMO-UHFFFAOYSA-N
Mol Weight 247.25 g/mol
Molecular Formula C12H13N3O3
Exact Mass 247.095691 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KU6LlVvfWa6
Name 6-cyano-5-keto-7-methyl-2,3-dihydro-1H-imidazo[1,2-a]pyridine-8-carboxylic acid ethyl ester
Alternate Name(s) 6-cyano-7-methyl-5-oxo-2,3-dihydro-1H-imidazo[1,2-a]pyridine-8-carboxylic acid ethyl ester ethyl 6-cyano-7-methyl-5-oxidanylidene-2,3-dihydro-1H-imidazo[1,2-a]pyridine-8-carboxylate ethyl 6-cyano-7-methyl-5-oxo-2,3-dihydro-1H-imidazo[1,2-a]pyridine-8-carboxylate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13N3O3
InChI InChI=1S/C12H13N3O3/c1-3-18-12(17)9-7(2)8(6-13)11(16)15-5-4-14-10(9)15/h14H,3-5H2,1-2H3
InChIKey BXWTUKMAMUHIMO-UHFFFAOYSA-N
Molecular Weight 247.254 g/mol
SMILES N1CCN2C(C(=C(C(=C12)C(=O)OCC)C)C#N)=O
SPLASH splash10-0udj-0090000000-b40fcc093e6221a250a3
Source of Spectrum Y-31-395-4
Wiley ID 761375