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(2R,5R,6R)-2-t-butyl-5-isopropyl-5,6-dimethyl-1,3-dioxan-4-one
SpectraBase Compound ID 3OAo7slnBgY
InChI InChI=1S/C13H24O3/c1-8(2)13(7)9(3)15-11(12(4,5)6)16-10(13)14/h8-9,11H,1-7H3/t9-,11-,13-/m1/s1
InChIKey GFICPWZJHLTBFM-IRUJWGPZSA-N
Mol Weight 228.33 g/mol
Molecular Formula C13H24O3
Exact Mass 228.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1QDkvRzRIlU
Name (2R,5R,6R)-2-t-butyl-5-isopropyl-5,6-dimethyl-1,3-dioxan-4-one
CAS Registry Number 134528-91-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H24O3
InChI InChI=1S/C13H24O3/c1-8(2)13(7)9(3)15-11(12(4,5)6)16-10(13)14/h8-9,11H,1-7H3/t9-,11-,13-/m1/s1
InChIKey GFICPWZJHLTBFM-IRUJWGPZSA-N
Molecular Weight 228.332 g/mol
SMILES C1([C@@]([C@@](C)(O[C@](O1)(C(C)(C)C)[H])[H])(C(C)C)C)=O
SPLASH splash10-000t-9000000000-19f156cf3c2f2060df2f
Source of Spectrum K-124-1841-11
Synonyms (2R,5R,6R)-2-tert-butyl-5-isopropyl-5,6-dimethyl-1,3-dioxan-4-one
Wiley ID 1229788