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Benzeneacetonitrile, .alpha.,.alpha.'-[1,4-phenylenedimethylidyne]bis[4-nitro-
SpectraBase Compound ID LZ5gGbueT1O
InChI InChI=1S/C24H14N4O4/c25-15-21(19-5-9-23(10-6-19)27(29)30)13-17-1-2-18(4-3-17)14-22(16-26)20-7-11-24(12-8-20)28(31)32/h1-14H/b21-13+,22-14+
InChIKey BNPWYAQUMWGYNR-JFMUQQRKSA-N
Mol Weight 422.4 g/mol
Molecular Formula C24H14N4O4
Exact Mass 422.101505 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K6yrQMTXuOI
Name Benzeneacetonitrile, .alpha.,.alpha.'-[1,4-phenylenedimethylidyne]bis[4-nitro-
Alternate Name(s) 3,3'-(1,4-phenylene)bis(2-(4-nitrophenyl)acrylonitrile) 3-[4-[2-cyano-2-(4-nitrophenyl)ethenyl]phenyl]-2-(4-nitrophenyl)-2-propenenitrile 3-[4-[2-cyano-2-(4-nitrophenyl)vinyl]phenyl]-2-(4-nitrophenyl)prop-2-enenitrile 3-[4-[2-cyano-2-(4-nitrophenyl)ethenyl]phenyl]-2-(4-nitrophenyl)prop-2-enenitrile
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Formula C24H14N4O4
InChI InChI=1S/C24H14N4O4/c25-15-21(19-5-9-23(10-6-19)27(29)30)13-17-1-2-18(4-3-17)14-22(16-26)20-7-11-24(12-8-20)28(31)32/h1-14H/b21-13+,22-14+
InChIKey BNPWYAQUMWGYNR-JFMUQQRKSA-N
Molecular Weight 422.400 g/mol
SMILES c1([N+]([O-])=O)ccc(cc1)\C(=C\c1ccc(\C=C/(C#N)c2ccc(cc2)[N+]([O-])=O)cc1)C#N
SPLASH splash10-00di-2379800000-24483643ccbe1a5652af
Source of Spectrum JX-2015-4-284
Wiley ID 1725731