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3-cyclopropyl-2,5,5-trimethylcyclohex-2-en-1-one
SpectraBase Compound ID 7ktSbXfIf9j
InChI InChI=1S/C12H18O/c1-8-10(9-4-5-9)6-12(2,3)7-11(8)13/h9H,4-7H2,1-3H3
InChIKey ZSPJITJRGGGPMI-UHFFFAOYSA-N
Mol Weight 178.27 g/mol
Molecular Formula C12H18O
Exact Mass 178.135765 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ISvW6mHmg1Y
Name 3-cyclopropyl-2,5,5-trimethylcyclohex-2-en-1-one
Compound Number 20
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H18O
InChI InChI=1S/C12H18O/c1-8-10(9-4-5-9)6-12(2,3)7-11(8)13/h9H,4-7H2,1-3H3
InChIKey ZSPJITJRGGGPMI-UHFFFAOYSA-N
Literature Reference Author J.C.CHALCHAT,R.P.GARRY,B.LACROIX,A.MICHET
Literature Reference Citation MAGN.RES.CHEM.,23,977(1985)
Literature Reference DOI 10.1002/mrc.1260231119
Molecular Weight 178.274 g/mol
Solvent CDCl3
Source File Reference UWCS13752