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1,3,5-Cycloheptatriene, 7,7-dimethyl-2,4-diphenyl-
SpectraBase Compound ID 5sN6e2oXOdt
InChI InChI=1S/C21H20/c1-21(2)14-13-19(17-9-5-3-6-10-17)15-20(16-21)18-11-7-4-8-12-18/h3-16H,1-2H3
InChIKey JIOPJHJFJQRTCH-UHFFFAOYSA-N
Mol Weight 272.39 g/mol
Molecular Formula C21H20
Exact Mass 272.156501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GYTE6qMF8O2
Name 1,3,5-Cycloheptatriene, 7,7-dimethyl-2,4-diphenyl-
Alternate Name(s) 7,7-Dimethyl-2,4-diphenyl-1,3,5-cycloheptatriene 7,7-Dimethyl-2,4-diphenyl-cyclohepta-1,3,5-triene
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Formula C21H20
InChI InChI=1S/C21H20/c1-21(2)14-13-19(17-9-5-3-6-10-17)15-20(16-21)18-11-7-4-8-12-18/h3-16H,1-2H3
InChIKey JIOPJHJFJQRTCH-UHFFFAOYSA-N
Molecular Weight 272.391 g/mol
SMILES c1cc(C2=CC(=CC(C=C2)(C)C)c2ccccc2)ccc1
SPLASH splash10-0a4i-2590000000-6f8910dc13ed69c0adf7
Wiley ID 1497624