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7-.alpha.-Hydroxy-2,2,7-trimethylbicyclo[4.3.0]nonan-3-one
SpectraBase Compound ID K6N3Sw1UDie
InChI InChI=1S/C12H18O2/c1-11(2)8-6-7-12(3,14)9(8)4-5-10(11)13/h4-5,8-9,14H,6-7H2,1-3H3/t8-,9+,12-/m0/s1
InChIKey YTHDZTJLNYJRHB-SBMIAAHKSA-N
Mol Weight 194.27 g/mol
Molecular Formula C12H18O2
Exact Mass 194.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2C9Akt4aSum
Name 7-.alpha.-Hydroxy-2,2,7-trimethylbicyclo[4.3.0]nonan-3-one
Alternate Name(s) (1S,3aS,7aR)-1-Hydroxy-1,4,4-trimethyl-2,3,3a,7a-tetrahydro-1H,4H-inden-5-one 7-.alpha.-Hydroxy-3-oxo-2,2,7-trimethylbicyclo[4.3.0]nonan-4-en
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Formula C12H18O2
InChI InChI=1S/C12H18O2/c1-11(2)8-6-7-12(3,14)9(8)4-5-10(11)13/h4-5,8-9,14H,6-7H2,1-3H3/t8-,9+,12-/m0/s1
InChIKey YTHDZTJLNYJRHB-SBMIAAHKSA-N
Molecular Weight 194.274 g/mol
SMILES O[C@@]1([C@]2([C@@](C(C(=O)C=C2)(C)C)(CC1)[H])[H])C
SPLASH splash10-000i-0900000000-b2610fee99544a9016eb
Source of Spectrum AJ-65-2944-14
Wiley ID 771804