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(+)-(5S)-3-CARBETHOXYMETHYL-5-(1-METHYLETHENYL)-2-METHYL-2-CYCLOHEXEN-1-ONE
SpectraBase Compound ID 5ckbv8npihJ
InChI InChI=1S/C14H20O3/c1-5-17-14(16)8-12-6-11(9(2)3)7-13(15)10(12)4/h11H,2,5-8H2,1,3-4H3/t11-/m1/s1
InChIKey XVXVNDNJDMDDPH-LLVKDONJSA-N
Mol Weight 236.31 g/mol
Molecular Formula C14H20O3
Exact Mass 236.141245 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EVDjusFATMk
Name (+)-(5S)-3-CARBETHOXYMETHYL-5-(1-METHYLETHENYL)-2-METHYL-2-CYCLOHEXEN-1-ONE
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H20O3
InChI InChI=1S/C14H20O3/c1-5-17-14(16)8-12-6-11(9(2)3)7-13(15)10(12)4/h11H,2,5-8H2,1,3-4H3/t11-/m1/s1
InChIKey XVXVNDNJDMDDPH-LLVKDONJSA-N
Literature Reference Author H.J.LIU,B.Y.ZHU
Literature Reference Citation CAN.J.CHEM.,69,2008(1991)
Literature Reference DOI 10.1139/v91-290
Molecular Weight 236.311 g/mol
Solvent CDCl3
Source File Reference UWVP5103