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1-CHLORO-2-(1-CHLOROPROP-1-ENYL)-5-CARBOXY-CYClOHEX-1-EN-3-ONE
SpectraBase Compound ID JltBCWaCU6I
InChI InChI=1S/C10H10Cl2O3/c1-2-6(11)9-7(12)3-5(10(14)15)4-8(9)13/h2,5H,3-4H2,1H3,(H,14,15)/b6-2+
InChIKey IAMYRUXEWJTOOX-QHHAFSJGSA-N
Mol Weight 249.09 g/mol
Molecular Formula C10H10Cl2O3
Exact Mass 248.0007 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID MdJHRlhZQN
Name 1-CHLORO-2-(1-CHLOROPROP-1-ENYL)-5-CARBOXY-CYClOHEX-1-EN-3-ONE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H10Cl2O3
InChI InChI=1S/C10H10Cl2O3/c1-2-6(11)9-7(12)3-5(10(14)15)4-8(9)13/h2,5H,3-4H2,1H3,(H,14,15)/b6-2+
InChIKey IAMYRUXEWJTOOX-QHHAFSJGSA-N
Literature Reference Author R.G.S.BROWN,L.YAN,M.H.BEALE,P.HEDDEN
Literature Reference Citation PHYTOCHEM.,47,679(1998)
Literature Reference DOI 10.1016/S0031-9422(97)00575-X
Molecular Weight 249.094 g/mol
Solvent CDCl3
Source File Reference UWMS215