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rel-(2S,4R,6R)-2-n-Hexyl-4,5,5,6-tetramethyl-1,3-dioxane
SpectraBase Compound ID KC4T1Q9unFH
InChI InChI=1S/C14H28O2/c1-6-7-8-9-10-13-15-11(2)14(4,5)12(3)16-13/h11-13H,6-10H2,1-5H3/t11-,12-/m0/s1
InChIKey IVQXQHWFERKWDF-RYUDHWBXSA-N
Mol Weight 228.38 g/mol
Molecular Formula C14H28O2
Exact Mass 228.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1wJRvxDd4WC
Name rel-(2S,4R,6R)-2-n-Hexyl-4,5,5,6-tetramethyl-1,3-dioxane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H28O2
InChI InChI=1S/C14H28O2/c1-6-7-8-9-10-13-15-11(2)14(4,5)12(3)16-13/h11-13H,6-10H2,1-5H3/t11-,12-/m0/s1
InChIKey IVQXQHWFERKWDF-RYUDHWBXSA-N
Molecular Weight 228.376 g/mol
SMILES C1([C@@](OC(O[C@]1(C)[H])CCCCCC)(C)[H])(C)C
SPLASH splash10-00di-9000000000-e683c0987f5d6d0f9de9
Source of Spectrum J-56-6466-13
Synonyms (4S,6S)-2-hexyl-4,5,5,6-tetramethyl-1,3-dioxane
Wiley ID 1230070