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2-[(E)-3-(1-cyclohepta-1,3,5-trienyl)prop-2-enylidene]propanedinitrile
SpectraBase Compound ID KCw8QL3Xo6Y
InChI InChI=1S/C13H10N2/c14-10-13(11-15)9-5-8-12-6-3-1-2-4-7-12/h1-6,8-9H,7H2/b8-5+
InChIKey MJEVDOPGILVKAJ-VMPITWQZSA-N
Mol Weight 194.24 g/mol
Molecular Formula C13H10N2
Exact Mass 194.084398 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4dZNKaGv9Wn
Name 2-[(E)-3-(1-cyclohepta-1,3,5-trienyl)prop-2-enylidene]propanedinitrile
Comments Less than 3 mono-isotopic peaks
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Formula C13H10N2
InChI InChI=1S/C13H10N2/c14-10-13(11-15)9-5-8-12-6-3-1-2-4-7-12/h1-6,8-9H,7H2/b8-5+
InChIKey MJEVDOPGILVKAJ-VMPITWQZSA-N
Molecular Weight 194.237 g/mol
SMILES C(C#N)(C#N)=C\C=C\C1=CC=CC=CC1
SPLASH splash10-0006-0900000000-aad10d147da0be1e692a
Source of Spectrum AJ-66-279-3
Synonyms 2-[(E)-3-cyclohepta-1,3,5-trien-1-ylprop-2-enylidene]malononitrile 2-[(E)-3-cyclohepta-1,3,5-trien-1-ylprop-2-enylidene]propanedinitrile
Wiley ID 771940