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Ethyl (E)-3-(5-oxo-4-phenyl-2,5-dihydroisoxazol-2-yl)propenoate
SpectraBase Compound ID DZVz0bzgu19
InChI InChI=1S/C14H13NO4/c1-2-18-13(16)8-9-15-10-12(14(17)19-15)11-6-4-3-5-7-11/h3-10H,2H2,1H3/b9-8+
InChIKey QCWANKAUMCTWLW-CMDGGOBGSA-N
Mol Weight 259.26 g/mol
Molecular Formula C14H13NO4
Exact Mass 259.084458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3kirwnHSSPM
Name Ethyl (E)-3-(5-oxo-4-phenyl-2,5-dihydroisoxazol-2-yl)propenoate
Alternate Name(s) Ethyl (2E)-3-(5-oxo-4-phenyl-2(5H)-isoxazolyl)-2-propenoate (E)-3-(5-oxo-4-phenyl-2-isoxazolyl)-2-propenoic acid ethyl ester Ethyl (E)-3-(5-oxo-4-phenyl-1,2-oxazol-2-yl)prop-2-enoate Ethyl (E)-3-(5-oxo-4-phenyl-isoxazol-2-yl)prop-2-enoate Ethyl (E)-3-(5-oxidanylidene-4-phenyl-1,2-oxazol-2-yl)prop-2-enoate
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Formula C14H13NO4
InChI InChI=1S/C14H13NO4/c1-2-18-13(16)8-9-15-10-12(14(17)19-15)11-6-4-3-5-7-11/h3-10H,2H2,1H3/b9-8+
InChIKey QCWANKAUMCTWLW-CMDGGOBGSA-N
Molecular Weight 259.261 g/mol
SMILES C=1(C(ON(C1)\C=C\C(=O)OCC)=O)c1ccccc1
SPLASH splash10-004i-5910000000-ad1bd87f52536dd27132
Source of Spectrum B-47-1673-0
Wiley ID 1262698