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(2R,5R,6R)-2-TERT.-BUTYL-6-METHYL-5-ISOPROPYL-1,3-DIOXAN-4-ONE
SpectraBase Compound ID COfQgf38D0T
InChI InChI=1S/C12H22O3/c1-7(2)9-8(3)14-11(12(4,5)6)15-10(9)13/h7-9,11H,1-6H3/t8-,9?,11-/m1/s1
InChIKey ZNQCVINNEKZFCC-RFSSFMFUSA-N
Mol Weight 214.3 g/mol
Molecular Formula C12H22O3
Exact Mass 214.156895 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 97t5zFQXpUS
Name (2R,5R,6R)-2-TERT.-BUTYL-6-METHYL-5-ISOPROPYL-1,3-DIOXAN-4-ONE
CAS Registry Number 129287-66-7
Compound Number 30
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H22O3
InChI InChI=1S/C12H22O3/c1-7(2)9-8(3)14-11(12(4,5)6)15-10(9)13/h7-9,11H,1-6H3/t8-,9?,11-/m1/s1
InChIKey ZNQCVINNEKZFCC-RFSSFMFUSA-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 214.305 g/mol
Solvent CDCl3
Source File Reference UWED12702