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(1'R,2R,5R,6R)-2-TERT.-BUTYL-6-METHYL-5-(1'-METHYLPENTYL)-1,3-DIOXAN-4-ONE
SpectraBase Compound ID IM7npcOF5W5
InChI InChI=1S/C15H28O3/c1-7-8-9-10(2)12-11(3)17-14(15(4,5)6)18-13(12)16/h10-12,14H,7-9H2,1-6H3/t10-,11-,12?,14-/m1/s1
InChIKey PTDZLWYNNDSXRD-XHMIPKSJSA-N
Mol Weight 256.39 g/mol
Molecular Formula C15H28O3
Exact Mass 256.203845 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KCZMcnMDYcs
Name (1'S,2R,5R,6R)-2-TERT.-BUTYL-6-METHYL-5-(1'-METHYLPENTYL)-1,3-DIOXAN-4-ONE
CAS Registry Number 129287-67-8
Compound Number 31
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H28O3
InChI InChI=1S/C15H28O3/c1-7-8-9-10(2)12-11(3)17-14(15(4,5)6)18-13(12)16/h10-12,14H,7-9H2,1-6H3/t10-,11-,12?,14-/m1/s1
InChIKey PTDZLWYNNDSXRD-XHMIPKSJSA-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 256.386 g/mol
Solvent CDCl3
Source File Reference UWED12703