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3-Cyano-4-(4-nitrophenyl)-1,2,4-oxadiazin-5(6H)-one
SpectraBase Compound ID KzZSfAiFMOC
InChI InChI=1S/C10H6N4O4/c11-5-9-12-18-6-10(15)13(9)7-1-3-8(4-2-7)14(16)17/h1-4H,6H2
InChIKey SPTFQDWNTGLRFL-UHFFFAOYSA-N
Mol Weight 246.18 g/mol
Molecular Formula C10H6N4O4
Exact Mass 246.038905 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DjCILnXst5j
Name 3-Cyano-4-(4-nitrophenyl)-1,2,4-oxadiazin-5(6H)-one
Alternate Name(s) 4-(4-nitrophenyl)-5-oxo-5,6-dihydro-4H-1,2,4-oxadiazine-3-carbonitrile 4-(4-nitrophenyl)-5-oxo-1,2,4-oxadiazine-3-carbonitrile 4-(4-nitrophenyl)-5-oxidanylidene-1,2,4-oxadiazine-3-carbonitrile
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Formula C10H6N4O4
InChI InChI=1S/C10H6N4O4/c11-5-9-12-18-6-10(15)13(9)7-1-3-8(4-2-7)14(16)17/h1-4H,6H2
InChIKey SPTFQDWNTGLRFL-UHFFFAOYSA-N
Molecular Weight 246.182 g/mol
SMILES C=1(N(C(CON1)=O)c1ccc(N(=O)=O)cc1)C#N
SPLASH splash10-0gb9-0590000000-ec6a2099143067ca4ed7
Source of Spectrum H1-51-2663-12
Wiley ID 817355