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exo-6-Methyl-3-(5-cyano-2-phenyloxazolidin-3-yl)benzopyran-4-one
SpectraBase Compound ID JmuKBTXczZR
InChI InChI=1S/C20H16N2O3/c1-13-7-8-19-16(9-13)20(23)17(12-24-19)18-10-15(11-21)25-22(18)14-5-3-2-4-6-14/h2-9,12,15,18H,10H2,1H3/t15-,18+/m1/s1
InChIKey NXQOKGBWJKTIML-QAPCUYQASA-N
Mol Weight 332.36 g/mol
Molecular Formula C20H16N2O3
Exact Mass 332.116092 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FFKWZMytJvA
Name exo-6-Methyl-3-(5-cyano-2-phenyloxazolidin-3-yl)benzopyran-4-one
Alternate Name(s) (3S,5R)-3-(6-Methyl-4-oxo-4H-chromen-3-yl)-2-phenyl-isoxazolidine-5-carbonitrile 3-(6-Methyl-4-oxo-4H-chromen-3-yl)-2-phenyl-5-isoxazolidinecarbonitrile exo-6-Methyl-3-(5-cyano-2-phenyl-isooxazol-3-yl)benzopyran-4-one exo-6-Methyl-3-(5-cyano-2-phenyl-isooxazolidin-3-yl)benzopyran-4-one exo-6-Methyl-3-(5-cyano-2-phenyloxazol-3-yl)benzopyran-4-one (3S,5R)-3-(6-methyl-4-oxo-1-benzopyran-3-yl)-2-phenyl-5-isoxazolidinecarbonitrile (3S,5R)-3-(6-methyl-4-oxochromen-3-yl)-2-phenyl-1,2-oxazolidine-5-carbonitrile (3S,5R)-3-(6-methyl-4-oxo-chromen-3-yl)-2-phenyl-isoxazolidine-5-carbonitrile (3S,5R)-3-(6-methyl-4-oxidanylidene-chromen-3-yl)-2-phenyl-1,2-oxazolidine-5-carbonitrile
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Formula C20H16N2O3
InChI InChI=1S/C20H16N2O3/c1-13-7-8-19-16(9-13)20(23)17(12-24-19)18-10-15(11-21)25-22(18)14-5-3-2-4-6-14/h2-9,12,15,18H,10H2,1H3/t15-,18+/m1/s1
InChIKey NXQOKGBWJKTIML-QAPCUYQASA-N
Molecular Weight 332.359 g/mol
SMILES C=1([C@]2(N(O[C@](C2)(C#N)[H])c2ccccc2)[H])C(c2cc(C)ccc2OC1)=O
SPLASH splash10-01p9-0960000000-91a5477a8543e1daef30
Source of Spectrum F-56-7826-20
Wiley ID 858793