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TERT.-BUTYL-(E,E)-2,6-OCTADIEN-8-CARBOXYLIC-ACID-1-OATE
SpectraBase Compound ID GaChFoUSAMt
InChI InChI=1S/C12H18O4/c1-12(2,3)16-11(15)9-7-5-4-6-8-10(13)14/h6-9H,4-5H2,1-3H3,(H,13,14)/b8-6+,9-7+
InChIKey LXVLRLAYBKZFHR-CDJQDVQCSA-N
Mol Weight 226.27 g/mol
Molecular Formula C12H18O4
Exact Mass 226.120509 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3BsXkBpXdiC
Name TERT.-BUTYL-(E,E)-2,6-OCTADIEN-8-CARBOXYLIC-ACID-1-OATE
Compound Number 15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H18O4
InChI InChI=1S/C12H18O4/c1-12(2,3)16-11(15)9-7-5-4-6-8-10(13)14/h6-9H,4-5H2,1-3H3,(H,13,14)/b8-6+,9-7+
InChIKey LXVLRLAYBKZFHR-CDJQDVQCSA-N
Literature Reference Author N.M.GARRIDO,M.M.E.HAMMOUMI,D.DIEZ,M.GARCIA,J.G.URONES
Literature Reference Citation MOLECULES,9,373(2004)
Literature Reference DOI 10.3390/90500373
Molecular Weight 226.273 g/mol
Solvent CDCl3
Source File Reference UWMS5964