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METHYL-(-)-(1S,6R)-6-ISOPROPENYL-3-METHYL-2-OXOCYCLOHEX-3-ENECARBOXYLATE
SpectraBase Compound ID BPPIQ9G4014
InChI InChI=1S/C12H16O3/c1-7(2)9-6-5-8(3)11(13)10(9)12(14)15-4/h5,9-10H,1,6H2,2-4H3/t9?,10-/m0/s1
InChIKey QUCXNOJQQNGQSR-AXDSSHIGSA-N
Mol Weight 208.26 g/mol
Molecular Formula C12H16O3
Exact Mass 208.109944 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BSVGLInGfSl
Name METHYL-(-)-(1S,6R)-6-ISOPROPENYL-3-METHYL-2-OXOCYCLOHEX-3-ENECARBOXYLATE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H16O3
InChI InChI=1S/C12H16O3/c1-7(2)9-6-5-8(3)11(13)10(9)12(14)15-4/h5,9-10H,1,6H2,2-4H3/t9?,10-/m0/s1
InChIKey QUCXNOJQQNGQSR-AXDSSHIGSA-N
Literature Reference Author A.ABAD,C.AGULLO,M.ARNO,A.CANTIN,A.C.CUNAT,B.MESEGUER,R.J.ZAR AGOZA
Literature Reference Citation J.CHEM.SOC.PERKIN-1,1837(1997)
Literature Reference DOI 10.1039/a700354d
Molecular Weight 208.257 g/mol
Solvent CDCl3