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6.beta.-n-Butyl-2.alpha.-tert-butyl-2.beta.,6.alpha.-dimethyl-1,3-dioxan-4-one
SpectraBase Compound ID FthJtCL2QLW
InChI InChI=1S/C14H26O3/c1-7-8-9-13(5)10-11(15)16-14(6,17-13)12(2,3)4/h7-10H2,1-6H3/t13-,14-/m1/s1
InChIKey HGCKGRSYYFXGRT-ZIAGYGMSSA-N
Mol Weight 242.36 g/mol
Molecular Formula C14H26O3
Exact Mass 242.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LLPjUAp0amJ
Name 6.beta.-n-Butyl-2.alpha.-tert-butyl-2.beta.,6.alpha.-dimethyl-1,3-dioxan-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H26O3
InChI InChI=1S/C14H26O3/c1-7-8-9-13(5)10-11(15)16-14(6,17-13)12(2,3)4/h7-10H2,1-6H3/t13-,14-/m1/s1
InChIKey HGCKGRSYYFXGRT-ZIAGYGMSSA-N
Molecular Weight 242.359 g/mol
SMILES [C@@]1(OC(=O)C[C@](O1)(CCCC)C)(C(C)(C)C)C
SPLASH splash10-002g-9510000000-35f81ba8a3fd4b1ecd8a
Source of Spectrum C-116-3319-6
Synonyms (2S,6R)-6-butyl-2-tert-butyl-2,6-dimethyl-1,3-dioxan-4-one
Wiley ID 1245203