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1,1,5-TRIMETHYL-2-HYDROXYMETHYL-(2,5)-CYCLOHEXADIEN-4-ONE
SpectraBase Compound ID EUN0kzWHXNO
InChI InChI=1S/C10H14O2/c1-7-5-10(2,3)8(6-11)4-9(7)12/h4-5,11H,6H2,1-3H3
InChIKey CETOKVXUOWMMMU-UHFFFAOYSA-N
Mol Weight 166.22 g/mol
Molecular Formula C10H14O2
Exact Mass 166.09938 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B10oABaY75o
Name 1,1,5-TRIMETHYL-2-HYDROXYMETHYL-(2,5)-CYCLOHEXADIEN-4-ONE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H14O2
InChI InChI=1S/C10H14O2/c1-7-5-10(2,3)8(6-11)4-9(7)12/h4-5,11H,6H2,1-3H3
InChIKey CETOKVXUOWMMMU-UHFFFAOYSA-N
Literature Reference Author Y.SHIKISHIMA,Y.TAKAISHI,G.HONDA,M.ITO,Y.TAKEDA,O.K.KODZHIMAT OV,O.ASHURMETOV
Literature Reference Citation PHYTOCHEM.,57,135(2001)
Literature Reference DOI 10.1016/S0031-9422(00)00407-6
Molecular Weight 166.220 g/mol
Solvent CDCl3
Source File Reference UWVN2132