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(1R*,2R*,5R*)-2-Hydroxy-2-methylbicyclo[3.2.2]non-6-en-3-one
SpectraBase Compound ID 1qtpD1VuQas
InChI InChI=1S/C10H14O2/c1-10(12)8-4-2-7(3-5-8)6-9(10)11/h2,4,7-8,12H,3,5-6H2,1H3/t7-,8-,10-/m1/s1
InChIKey IUXMIZJLJFCHNV-NQMVMOMDSA-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 BUbnstUWMzD
Name (1R*,2R*,5R*)-2-Hydroxy-2-methylbicyclo[3.2.2]non-6-en-3-one
Appearance Pale yellow oil
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Formula C10H14O2
InChI InChI=1S/C10H14O2/c1-10(12)8-4-2-7(3-5-8)6-9(10)11/h2,4,7-8,12H,3,5-6H2,1H3/t7-,8-,10-/m1/s1
InChIKey IUXMIZJLJFCHNV-NQMVMOMDSA-N
Instrument Name Hewlett-Packard 5971A or Thermo-Finnigan Polaris Q or Jeol JSM-GCMat-eII or JMS-SX 102
Ionization Type EI
Literature Reference DOI 10.1016/j.arabjc.2017.08.008
Molecular Weight 166.220 g/mol
Reported Formula C10H4O2
SMILES O[C@@]1(C)C(C[C@@]2(C=C[C@@]1(CC2)[H])[H])=O
SPLASH splash10-005a-9000000000-676b0798da25d94d67d4
Source of Spectrum AJC-13-910-22a
Thin-Layer Chromatography Rf = 0.85 (hexane/EtOAc, 7:3)
Wiley ID 1857424