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2,3-DIMETHYLCYCLOTETRADECANE-1,4-DIONE;ISOMER-1
SpectraBase Compound ID C7pHYhd61s3
InChI InChI=1S/C16H28O2/c1-13-14(2)16(18)12-10-8-6-4-3-5-7-9-11-15(13)17/h13-14H,3-12H2,1-2H3
InChIKey HCTLJJMNYKXJIE-UHFFFAOYSA-N
Mol Weight 252.4 g/mol
Molecular Formula C16H28O2
Exact Mass 252.20893 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IrKRKvdABe2
Name 2,3-DIMETHYLCYCLOTETRADECANE-1,4-DIONE;ISOMER-2
Compound Number 12G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H28O2
InChI InChI=1S/C16H28O2/c1-13-14(2)16(18)12-10-8-6-4-3-5-7-9-11-15(13)17/h13-14H,3-12H2,1-2H3
InChIKey HCTLJJMNYKXJIE-UHFFFAOYSA-N
Literature Reference Author G.RUEEDI,M.A.OBERLI,M.NAGEL,H.J.HANSEN
Literature Reference Citation ORG.LETTERS,6,3179(2004)
Literature Reference DOI 10.1021/ol048701e
Molecular Weight 252.397 g/mol
Sample ID 34661
Solvent CDCl3