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(2R,5S)-2-tert-Butyl-6,6-dimethyl-5-propyl-1,3-dioxan-4-one
SpectraBase Compound ID 72v1Kz4NhB2
InChI InChI=1S/C13H24O3/c1-7-8-9-10(14)15-11(12(2,3)4)16-13(9,5)6/h9,11H,7-8H2,1-6H3/t9-,11+/m1/s1
InChIKey ZPVOSWLMFZZYEG-KOLCDFICSA-N
Mol Weight 228.33 g/mol
Molecular Formula C13H24O3
Exact Mass 228.172545 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KapltQRsci3
Name (2R,5S)-2-TERT.-BUTYL-6,6-DIMETHYL-5-PROPYL-1,3-DIOXAN-4-ONE
CAS Registry Number 128973-61-5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H24O3
InChI InChI=1S/C13H24O3/c1-7-8-9-10(14)15-11(12(2,3)4)16-13(9,5)6/h9,11H,7-8H2,1-6H3/t9-,11+/m1/s1
InChIKey ZPVOSWLMFZZYEG-KOLCDFICSA-N
Literature Reference Author W.AMBERG,D.SEEBACH
Literature Reference Citation CHEM.BER.,123,2429(1990)
Literature Reference DOI 10.1002/cber.19901231226
Molecular Weight 228.332 g/mol
Solvent Unknown
Source File Reference UWED12108