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exo-4b,5-epoxy-cis-5,6,7,8,9,9a-hexahydro-4bh-benzo(3,4)cyclobuta(1,2)cycloheptene
SpectraBase Compound ID 3x5BfDdqSp7
InChI InChI=1S/C13H14O/c1-2-6-10-9(5-1)11-7-3-4-8-12-13(10,11)14-12/h1-2,5-6,11-12H,3-4,7-8H2
InChIKey GKPMUKIHIKGTKW-UHFFFAOYSA-N
Mol Weight 186.25 g/mol
Molecular Formula C13H14O
Exact Mass 186.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GiY4C39ycwa
Name exo-4b,5-epoxy-cis-5,6,7,8,9,9a-hexahydro-4bh-benzo(3,4)cyclobuta(1,2)cycloheptene
Alternate Name(s) 1a,2,3,4,5,5a-hexahydrobenzo[3',4']cyclobuta[1',2':2,3]cyclohepta[1,2-b]oxirene
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Formula C13H14O
InChI InChI=1S/C13H14O/c1-2-6-10-9(5-1)11-7-3-4-8-12-13(10,11)14-12/h1-2,5-6,11-12H,3-4,7-8H2
InChIKey GKPMUKIHIKGTKW-UHFFFAOYSA-N
Molecular Weight 186.254 g/mol
SMILES C123OC3CCCCC1c1ccccc21
SPLASH splash10-0a6r-0900000000-3364ff3c69d2c196c6f7
Source of Spectrum B-31-1600-0
Wiley ID 1183402