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2-[2-(1-cyclohepta-2,4,6-trienyl)-1-(4-iodophenyl)ethylidene]propanedinitrile
SpectraBase Compound ID KGF86RceeXt
InChI InChI=1S/C18H13IN2/c19-17-9-7-15(8-10-17)18(16(12-20)13-21)11-14-5-3-1-2-4-6-14/h1-10,14H,11H2
InChIKey RRJVTUJPOYDCFC-UHFFFAOYSA-N
Mol Weight 384.22 g/mol
Molecular Formula C18H13IN2
Exact Mass 384.012343 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 66NyLekbVPl
Name 2-[2-(1-cyclohepta-2,4,6-trienyl)-1-(4-iodophenyl)ethylidene]propanedinitrile
Alternate Name(s) 2-[2-cyclohepta-2,4,6-trien-1-yl-1-(4-iodophenyl)ethylidene]malononitrile 2-[2-cyclohepta-2,4,6-trien-1-yl-1-(4-iodophenyl)ethylidene]propanedinitrile
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Formula C18H13IN2
InChI InChI=1S/C18H13IN2/c19-17-9-7-15(8-10-17)18(16(12-20)13-21)11-14-5-3-1-2-4-6-14/h1-10,14H,11H2
InChIKey RRJVTUJPOYDCFC-UHFFFAOYSA-N
Molecular Weight 384.220 g/mol
SMILES C(=C(C#N)C#N)(c1ccc(cc1)I)CC1C=CC=CC=C1
SPLASH splash10-000f-3932000000-3b63b68a63c9338ccc3c
Source of Spectrum H-84-772-3
Wiley ID 847476