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2-Oxatricyclo[6.3.0.0(1,5)]undecan-3-one
SpectraBase Compound ID 2L4MereUNum
InChI InChI=1S/C10H14O2/c11-9-6-8-4-3-7-2-1-5-10(7,8)12-9/h7-8H,1-6H2/t7?,8-,10-/m0/s1
InChIKey AVFUEVMPLVIILZ-CFGJQEBVSA-N
Mol Weight 166.22 g/mol
Molecular Formula C10H14O2
Exact Mass 166.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IzKc6tuyJWm
Name 2-Oxatricyclo[6.3.0.0(1,5)]undecan-3-one
Alternate Name(s) (1S,5S)-2-Oxatricyclo[6.3.0.0(1,5)]undecan-3-one (3aS,8aS)-Octahydro-pentaleno[6a,1-b]furan-2-one Octahydro-2H-pentaleno[6a,1-b]furan-2-one
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Formula C10H14O2
InChI InChI=1S/C10H14O2/c11-9-6-8-4-3-7-2-1-5-10(7,8)12-9/h7-8H,1-6H2/t7?,8-,10-/m0/s1
InChIKey AVFUEVMPLVIILZ-CFGJQEBVSA-N
Molecular Weight 166.220 g/mol
SMILES [C@@]123OC(=O)C[C@@]3(CCC1CCC2)[H]
SPLASH splash10-002o-9000000000-2c0bd36da8501a9c7193
Source of Spectrum J-62-5971-27
Wiley ID 1162778