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2-cyano-3-(3-phenylsydnon-4-yl)acrylic acid ethyl ester
SpectraBase Compound ID LsrfMmTnxOA
InChI InChI=1S/C14H11N3O4/c1-2-20-13(18)10(9-15)8-12-14(19)21-16-17(12)11-6-4-3-5-7-11/h3-8H,2H2,1H3
InChIKey KYUWYRWGQUFWTQ-UHFFFAOYSA-N
Mol Weight 285.26 g/mol
Molecular Formula C14H11N3O4
Exact Mass 285.074956 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JTR48DnFEPW
Name 2-cyano-3-(3-phenylsydnon-4-yl)acrylic acid ethyl ester
Alternate Name(s) (Z,3E)-2-cyano-1-ethoxy-3-(5-oxo-3-phenyl-4-oxadiazol-3-iumylidene)-1-propen-1-olate (Z,3E)-2-cyano-1-ethoxy-3-(5-oxo-3-phenyloxadiazol-3-ium-4-ylidene)prop-1-en-1-olate (Z,3E)-2-cyano-1-ethoxy-3-(5-oxo-3-phenyl-oxadiazol-3-ium-4-ylidene)prop-1-en-1-olate (Z,3E)-2-cyano-1-ethoxy-3-(5-oxidanylidene-3-phenyl-1,2,3-oxadiazol-3-ium-4-ylidene)prop-1-en-1-olate
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Formula C14H11N3O4
InChI InChI=1S/C14H11N3O4/c1-2-20-13(18)10(9-15)8-12-14(19)21-16-17(12)11-6-4-3-5-7-11/h3-8H,2H2,1H3
InChIKey KYUWYRWGQUFWTQ-UHFFFAOYSA-N
Molecular Weight 285.259 g/mol
SMILES c1([n+](noc1[O-])-c1ccccc1)\C=C\(C(=O)OCC)C#N
SPLASH splash10-004i-7390000000-a40af07961f145ce16d2
Source of Spectrum F-59-4108-5e
Wiley ID 1678046