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11H-dihydrobicyclo[2.2.1]hepteno[b]cyclopent[4,5-a]azulen-11-one
SpectraBase Compound ID IYpou8TISB1
InChI InChI=1S/C18H14O/c19-18-16-12-7-6-11(8-12)15(16)14-9-10-4-2-1-3-5-13(10)17(14)18/h1-7,9,11-12,15-16H,8H2
InChIKey LWNBTFYQYIAZST-UHFFFAOYSA-N
Mol Weight 246.31 g/mol
Molecular Formula C18H14O
Exact Mass 246.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8UoYsjf7Hhc
Name 11H-dihydrobicyclo[2.2.1]hepteno[b]cyclopent[4,5-a]azulen-11-one
Alternate Name(s) pentacyclo[13.2.1.0(2,14).0(3,12).0(5,11)]octadeca-3(12),4,6,8,10,16-hexaen-13-one
Comments Less than 3 mono-isotopic peaks
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Formula C18H14O
InChI InChI=1S/C18H14O/c19-18-16-12-7-6-11(8-12)15(16)14-9-10-4-2-1-3-5-13(10)17(14)18/h1-7,9,11-12,15-16H,8H2
InChIKey LWNBTFYQYIAZST-UHFFFAOYSA-N
Molecular Weight 246.309 g/mol
SMILES c12c(C3C4C=CC(C3C2=O)C4)cc2c1ccccc2
SPLASH splash10-001i-0920000000-24680503db85344a19d7
Source of Spectrum AJ-65-2137-11
Wiley ID 771724