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2-ALLYL-2-METHYL-1,4-CYCLOHEXANEDIONE-4-MONOETHYLENE-ACETAL

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2-ALLYL-2-METHYL-1,4-CYCLOHEXANEDIONE-4-MONOETHYLENE-ACETAL
SpectraBase Compound ID fHHX9QNn4N
InChI InChI=1S/C12H18O3/c1-3-5-11(2)9-12(6-4-10(11)13)14-7-8-15-12/h3H,1,4-9H2,2H3
InChIKey DAINQMIQKIOHFU-UHFFFAOYSA-N
Mol Weight 210.27 g/mol
Molecular Formula C12H18O3
Exact Mass 210.125594 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3SHbnZIqHmZ
Name 2-ALLYL-2-METHYL-1,4-CYCLOHEXANEDIONE-4-MONOETHYLENE-ACETAL
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H18O3
InChI InChI=1S/C12H18O3/c1-3-5-11(2)9-12(6-4-10(11)13)14-7-8-15-12/h3H,1,4-9H2,2H3
InChIKey DAINQMIQKIOHFU-UHFFFAOYSA-N
Literature Reference Author D.SOLE,X.URBANEJA,J.BONJOCH
Literature Reference Citation ORG.LETTERS,7,5461(2005)
Literature Reference DOI 10.1021/ol052230u
Molecular Weight 210.273 g/mol
Sample ID 62883
Solvent CDCl3