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(1'S,2R,5S,6R)-2-TERT.-BUTYL-5-(1'-HYDROXY-ISOPENTYL)-6-METHYL-1,3-DIOXAN-4-ONE
SpectraBase Compound ID 31oFrujWpgx
InChI InChI=1S/C14H26O4/c1-8(2)7-10(15)11-9(3)17-13(14(4,5)6)18-12(11)16/h8-11,13,15H,7H2,1-6H3/t9-,10+,11?,13-/m1/s1
InChIKey NZHLYZHVXGTCRE-FIOVSDBCSA-N
Mol Weight 258.36 g/mol
Molecular Formula C14H26O4
Exact Mass 258.183109 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7mdPYOJ7dnt
Name (1'S,2R,5S,6R)-2-TERT.-BUTYL-5-(1'-HYDROXY-ISOPENTYL)-6-METHYL-1,3-DIOXAN-4-ONE
CAS Registry Number 129287-38-3
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H26O4
InChI InChI=1S/C14H26O4/c1-8(2)7-10(15)11-9(3)17-13(14(4,5)6)18-12(11)16/h8-11,13,15H,7H2,1-6H3/t9-,10+,11?,13-/m1/s1
InChIKey NZHLYZHVXGTCRE-FIOVSDBCSA-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 258.358 g/mol
Solvent CDCl3
Source File Reference UWED12694