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(2R,5R,6R)-5-benzyl-2-t-butyl-5,6-dimethyl-1,3-dioxan-4-one
SpectraBase Compound ID G2O0sGQyFPY
InChI InChI=1S/C17H24O3/c1-12-17(5,11-13-9-7-6-8-10-13)14(18)20-15(19-12)16(2,3)4/h6-10,12,15H,11H2,1-5H3/t12-,15-,17-/m1/s1
InChIKey UBLOVNSJLYIYTG-SRCQZFHVSA-N
Mol Weight 276.38 g/mol
Molecular Formula C17H24O3
Exact Mass 276.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GJ6kSohL4jd
Name (2R,5R,6R)-5-benzyl-2-t-butyl-5,6-dimethyl-1,3-dioxan-4-one
Alternate Name(s) (2R,5R,6R)-5-benzyl-2-tert-butyl-5,6-dimethyl-1,3-dioxan-4-one
CAS Registry Number 134528-85-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H24O3
InChI InChI=1S/C17H24O3/c1-12-17(5,11-13-9-7-6-8-10-13)14(18)20-15(19-12)16(2,3)4/h6-10,12,15H,11H2,1-5H3/t12-,15-,17-/m1/s1
InChIKey UBLOVNSJLYIYTG-SRCQZFHVSA-N
Molecular Weight 276.376 g/mol
SMILES [C@]1(C(O[C@@](O[C@@]1(C)[H])(C(C)(C)C)[H])=O)(Cc1ccccc1)C
SPLASH splash10-000y-2900000000-aa77eaf973af554562fe
Source of Spectrum K-124-1840-4
Wiley ID 1280370