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1,4-Methanoazulen-9-one, decahydro-8-methylene-, (1.alpha.,3a.beta.,4.alpha.,8a.beta.)-(.+-.)-
SpectraBase Compound ID AbcH3GvKjVi
InChI InChI=1S/C12H16O/c1-7-3-2-4-9-8-5-6-10(11(7)8)12(9)13/h8-11H,1-6H2/t8-,9-,10-,11-/m1/s1
InChIKey AXHVRVWWUXRHPJ-GWOFURMSSA-N
Mol Weight 176.26 g/mol
Molecular Formula C12H16O
Exact Mass 176.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 11wb7I2EU1l
Name 1,4-Methanoazulen-9-one, decahydro-8-methylene-, (1.alpha.,3a.beta.,4.alpha.,8a.beta.)-(.+-.)-
Alternate Name(s) (+-)-3-Methylidenetricyclo[5.4.0.0(2,9)]undecan-8-one 3-Methylenetricyclo[5.4.0.0(2,9)]undecan-8-one
CAS Registry Number 66857-09-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O
InChI InChI=1S/C12H16O/c1-7-3-2-4-9-8-5-6-10(11(7)8)12(9)13/h8-11H,1-6H2/t8-,9-,10-,11-/m1/s1
InChIKey AXHVRVWWUXRHPJ-GWOFURMSSA-N
Molecular Weight 176.259 g/mol
SMILES [C@@]12(C([C@@]3(CCCC([C@@]1([C@@]3(CC2)[H])[H])=C)[H])=O)[H]
SPLASH splash10-017l-9500000000-2c723e0f4df7fe1753d0
Source of Spectrum H-67-1163-0
Wiley ID 1172722