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(2R,5R,6R)-2-t-butyl-5-ethyl-5,6-dimethyl-1,3-dioxan-4-one
SpectraBase Compound ID FTyJNC4vOS1
InChI InChI=1S/C12H22O3/c1-7-12(6)8(2)14-10(11(3,4)5)15-9(12)13/h8,10H,7H2,1-6H3/t8-,10-,12-/m1/s1
InChIKey YXUBRGNKFDHLRZ-HLUHBDAQSA-N
Mol Weight 214.3 g/mol
Molecular Formula C12H22O3
Exact Mass 214.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GHtUkE4rmIb
Name (2R,5R,6R)-2-t-butyl-5-ethyl-5,6-dimethyl-1,3-dioxan-4-one
Alternate Name(s) (2R,5R,6R)-2-tert-butyl-5-ethyl-5,6-dimethyl-1,3-dioxan-4-one
CAS Registry Number 134528-89-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22O3
InChI InChI=1S/C12H22O3/c1-7-12(6)8(2)14-10(11(3,4)5)15-9(12)13/h8,10H,7H2,1-6H3/t8-,10-,12-/m1/s1
InChIKey YXUBRGNKFDHLRZ-HLUHBDAQSA-N
Molecular Weight 214.305 g/mol
SMILES C1([C@@]([C@@](C)(O[C@](O1)(C(C)(C)C)[H])[H])(CC)C)=O
SPLASH splash10-001l-9000000000-4e6cbec5496124da5071
Source of Spectrum K-124-1840-9
Wiley ID 1213641