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(2R,5R,6R)-5-(3'-BUTENYL)-2-TERT.-BUTYL-6-METHYL-1,3-DIOXAN-4-ONE
SpectraBase Compound ID IGJLqFKQpj2
InChI InChI=1S/C13H22O3/c1-6-7-8-10-9(2)15-12(13(3,4)5)16-11(10)14/h6,9-10,12H,1,7-8H2,2-5H3/t9-,10-,12-/m1/s1
InChIKey DCWHOPSPRXYZLG-CKYFFXLPSA-N
Mol Weight 226.32 g/mol
Molecular Formula C13H22O3
Exact Mass 226.156895 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7Nf10my15NN
Name (2R,5R,6R)-5-(3'-BUTENYL)-2-TERT.-BUTYL-6-METHYL-1,3-DIOXAN-4-ONE
CAS Registry Number 129287-75-8
Compound Number 37
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H22O3
InChI InChI=1S/C13H22O3/c1-6-7-8-10-9(2)15-12(13(3,4)5)16-11(10)14/h6,9-10,12H,1,7-8H2,2-5H3/t9-,10-,12-/m1/s1
InChIKey DCWHOPSPRXYZLG-CKYFFXLPSA-N
Literature Reference Author W.AMBERG,D.SEEBACH
Literature Reference Citation CHEM.BER.,123,2413(1990)
Literature Reference DOI 10.1002/cber.19901231225
Molecular Weight 226.316 g/mol
Solvent CDCl3
Source File Reference UWED12709