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2R,6S-6-Isoropyl-2-(t-butyl)-6-(trifluoromethyl)-1,3-dioxan-4-one
SpectraBase Compound ID 6b0zJW603F7
InChI InChI=1S/C12H19F3O3/c1-7(2)11(12(13,14)15)6-8(16)17-9(18-11)10(3,4)5/h7,9H,6H2,1-5H3/t9-,11-/m0/s1
InChIKey ILHAFXCWJAMMFN-ONGXEEELSA-N
Mol Weight 268.28 g/mol
Molecular Formula C12H19F3O3
Exact Mass 268.128629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FZHPO4qWrrb
Name 2R,6S-6-Isoropyl-2-(t-butyl)-6-(trifluoromethyl)-1,3-dioxan-4-one
Alternate Name(s) (2R,6S)-2-tert-butyl-6-isopropyl-6-(trifluoromethyl)-1,3-dioxan-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H19F3O3
InChI InChI=1S/C12H19F3O3/c1-7(2)11(12(13,14)15)6-8(16)17-9(18-11)10(3,4)5/h7,9H,6H2,1-5H3/t9-,11-/m0/s1
InChIKey ILHAFXCWJAMMFN-ONGXEEELSA-N
Molecular Weight 268.276 g/mol
SMILES [C@@]1(O[C@@](C(C)(C)C)(OC(C1)=O)[H])(C(F)(F)F)C(C)C
SPLASH splash10-066r-9410000000-b5f09c72a2b073153f0e
Source of Spectrum K-127-575-21
Wiley ID 1271745