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5-[6-(methylamino)-7-oxo-1-cyclohepta-1,3,5-trienyl]-3-isoxazolecarboxylic acid ethyl ester
SpectraBase Compound ID Et4jsm4EUPd
InChI InChI=1S/C14H14N2O4/c1-3-19-14(18)11-8-12(20-16-11)9-6-4-5-7-10(15-2)13(9)17/h4-8H,3H2,1-2H3,(H,15,17)
InChIKey SRLIBQYGMYQPNW-UHFFFAOYSA-N
Mol Weight 274.28 g/mol
Molecular Formula C14H14N2O4
Exact Mass 274.095357 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JouBqz89ogL
Name 5-[6-(methylamino)-7-oxo-1-cyclohepta-1,3,5-trienyl]-3-isoxazolecarboxylic acid ethyl ester
Alternate Name(s) 5-[7-keto-6-(methylamino)cyclohepta-1,3,5-trien-1-yl]isoxazole-3-carboxylic acid ethyl ester Ethyl 5-[6-(methylamino)-7-oxidanylidene-cyclohepta-1,3,5-trien-1-yl]-1,2-oxazole-3-carboxylate Ethyl 5-[6-(methylamino)-7-oxo-cyclohepta-1,3,5-trien-1-yl]isoxazole-3-carboxylate Ethyl 5-[6-(methylamino)-7-oxocyclohepta-1,3,5-trien-1-yl]-1,2-oxazole-3-carboxylate
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Formula C14H14N2O4
InChI InChI=1S/C14H14N2O4/c1-3-19-14(18)11-8-12(20-16-11)9-6-4-5-7-10(15-2)13(9)17/h4-8H,3H2,1-2H3,(H,15,17)
InChIKey SRLIBQYGMYQPNW-UHFFFAOYSA-N
Molecular Weight 274.276 g/mol
SMILES N(C=1C(C(c2cc(no2)C(=O)OCC)=CC=CC1)=O)C
SPLASH splash10-0fb9-0970000000-c76c257ef37f66602e2d
Source of Spectrum Y-35-393-6
Wiley ID 1277951