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(2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexan-1-one
SpectraBase Compound ID CFjFqqh19bq
InChI InChI=1S/C16H22O/c1-12-9-10-14(15(17)11-12)16(2,3)13-7-5-4-6-8-13/h4-8,12,14H,9-11H2,1-3H3/t12-,14-/m1/s1
InChIKey YTGBBHOCDKGLED-TZMCWYRMSA-N
Mol Weight 230.35 g/mol
Molecular Formula C16H22O
Exact Mass 230.167065 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G2HzxMOoyXW
Name (2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexan-1-one
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H22O
InChI InChI=1S/C16H22O/c1-12-9-10-14(15(17)11-12)16(2,3)13-7-5-4-6-8-13/h4-8,12,14H,9-11H2,1-3H3/t12-,14-/m1/s1
InChIKey YTGBBHOCDKGLED-TZMCWYRMSA-N
Literature Reference Author L.MEYER,J.M.POIRIER,P.DUHAMEL,L.DUHAMEL
Literature Reference Citation J.ORG.CHEM.,63,8094(1998)
Literature Reference DOI 10.1021/jo981710e
Molecular Weight 230.350 g/mol
Sample ID 26827
Solvent CDCl3