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Ethyl 3-(2'-oxo-2H-[1]benzopyran-4'-yl)-3-methyl-4,5-dihydroisoxazole-4-carboxylate
SpectraBase Compound ID JO56G3RI7vO
InChI InChI=1S/C16H15NO5/c1-3-20-16(19)14-9(2)17-22-15(14)11-8-13(18)21-12-7-5-4-6-10(11)12/h4-8,14-15H,3H2,1-2H3/t14-,15+/m1/s1
InChIKey POYVXBHQTZERRI-CABCVRRESA-N
Mol Weight 301.3 g/mol
Molecular Formula C16H15NO5
Exact Mass 301.095023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5LLAaNtCeCW
Name Ethyl 3-(2'-oxo-2H-[1]benzopyran-4'-yl)-3-methyl-4,5-dihydroisoxazole-4-carboxylate
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Formula C16H15NO5
InChI InChI=1S/C16H15NO5/c1-3-20-16(19)14-9(2)17-22-15(14)11-8-13(18)21-12-7-5-4-6-10(11)12/h4-8,14-15H,3H2,1-2H3/t14-,15+/m1/s1
InChIKey POYVXBHQTZERRI-CABCVRRESA-N
Molecular Weight 301.298 g/mol
SMILES C=1([C@]2([C@@](C(C)=NO2)(C(=O)OCC)[H])[H])c2c(cccc2)OC(C1)=O
SPLASH splash10-0ur0-6921000000-22f83156a5ed51dc72fb
Source of Spectrum Y-33-969-5
Synonyms (4R,5R)-3-Methyl-5-(2-oxo-2H-chromen-4-yl)-4,5-dihydro-isoxazole-4-carboxylic acid ethyl ester (4R,5R)-3-methyl-5-(2-oxo-1-benzopyran-4-yl)-4,5-dihydroisoxazole-4-carboxylic acid ethyl ester Ethyl (4R,5R)-3-methyl-5-(2-oxochromen-4-yl)-4,5-dihydro-1,2-oxazole-4-carboxylate Ethyl (4R,5R)-3-methyl-5-(2-oxochromen-4-yl)-4,5-dihydroisoxazole-4-carboxylate Ethyl (4R,5R)-3-methyl-5-(2-oxidanylidenechromen-4-yl)-4,5-dihydro-1,2-oxazole-4-carboxylate
Wiley ID 1303793