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2-(3-(4-Methoxyphenyl)sydnon-4-ylmethylene)malononitrile
SpectraBase Compound ID 8kZzwcsm8ro
InChI InChI=1S/C13H8N4O3/c1-19-11-4-2-10(3-5-11)17-12(13(18)20-16-17)6-9(7-14)8-15/h2-6H,1H3
InChIKey QSPLAOJPXPLAQB-UHFFFAOYSA-N
Mol Weight 268.23 g/mol
Molecular Formula C13H8N4O3
Exact Mass 268.05964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2kbeBiUdc3P
Name 2-(3-(4-Methoxyphenyl)sydnon-4-ylmethylene)malononitrile
Alternate Name(s) 4-(2,2-dicyanoethenyl)-3-(4-methoxyphenyl)-5-oxadiazol-3-iumolate 4-(2,2-dicyanoethenyl)-3-(4-methoxyphenyl)oxadiazol-3-ium-5-olate 4-(2,2-dicyanoethenyl)-3-(4-methoxyphenyl)-1,2,3-oxadiazol-3-ium-5-olate
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Formula C13H8N4O3
InChI InChI=1S/C13H8N4O3/c1-19-11-4-2-10(3-5-11)17-12(13(18)20-16-17)6-9(7-14)8-15/h2-6H,1H3
InChIKey QSPLAOJPXPLAQB-UHFFFAOYSA-N
Molecular Weight 268.232 g/mol
SMILES c1([n+](noc1[O-])-c1ccc(OC)cc1)C=C(C#N)C#N
SPLASH splash10-03di-0290000000-68596027f31f56646a0b
Source of Spectrum F-59-4108-5c
Wiley ID 1678048