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2R,6S-6-Allyl-2-(t-butyl)-6-(trifluoromethyl)-1,3-dioxan-4-one
SpectraBase Compound ID 8B7g2LM5q5
InChI InChI=1S/C12H17F3O3/c1-5-6-11(12(13,14)15)7-8(16)17-9(18-11)10(2,3)4/h5,9H,1,6-7H2,2-4H3/t9-,11-/m0/s1
InChIKey BESIBKLHHKELST-ONGXEEELSA-N
Mol Weight 266.26 g/mol
Molecular Formula C12H17F3O3
Exact Mass 266.112979 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cnr7L1d03Eb
Name 2R,6S-6-Allyl-2-(t-butyl)-6-(trifluoromethyl)-1,3-dioxan-4-one
Alternate Name(s) (2R,6S)-6-allyl-2-tert-butyl-6-(trifluoromethyl)-1,3-dioxan-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H17F3O3
InChI InChI=1S/C12H17F3O3/c1-5-6-11(12(13,14)15)7-8(16)17-9(18-11)10(2,3)4/h5,9H,1,6-7H2,2-4H3/t9-,11-/m0/s1
InChIKey BESIBKLHHKELST-ONGXEEELSA-N
Molecular Weight 266.260 g/mol
SMILES [C@]1(O[C@@](C(C)(C)C)(OC(C1)=O)[H])(C(F)(F)F)CC=C
SPLASH splash10-07bu-9310000000-cdfadc39487d67736d76
Source of Spectrum K-127-575-22
Wiley ID 1269593