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(-)-(1S,2S)-6,6-Dimethyl-2-(2-oxo-2-phenylethyl)bicyclo[3.1.1]heptane
SpectraBase Compound ID DUg1m2iTjy7
InChI InChI=1S/C17H22O/c1-17(2)14-9-8-13(15(17)11-14)10-16(18)12-6-4-3-5-7-12/h3-7,13-15H,8-11H2,1-2H3/t13-,14?,15-/m0/s1
InChIKey IDFLIHAYHDPJHC-LWEDLAQUSA-N
Mol Weight 242.36 g/mol
Molecular Formula C17H22O
Exact Mass 242.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8imAmHIoy5m
Name (-)-(1S,2S)-6,6-Dimethyl-2-(2-oxo-2-phenylethyl)bicyclo[3.1.1]heptane
Alternate Name(s) 2-[(1S,2S)-6,6-dimethylbicyclo[3.1.1]hept-2-yl]-1-phenylethanone
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Formula C17H22O
InChI InChI=1S/C17H22O/c1-17(2)14-9-8-13(15(17)11-14)10-16(18)12-6-4-3-5-7-12/h3-7,13-15H,8-11H2,1-2H3/t13-,14?,15-/m0/s1
InChIKey IDFLIHAYHDPJHC-LWEDLAQUSA-N
Molecular Weight 242.362 g/mol
SMILES [C@]12(C(C)(C)C(C2)CC[C@]1(CC(=O)c1ccccc1)[H])[H]
SPLASH splash10-0a4i-1900000000-6adfe0505ef25c713e42
Source of Spectrum J-61-8239-48
Wiley ID 1245681