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(1R,4S,5R,8R)-4,8-dimethyl-8-trifluoroacetoxy-2-oxabicyclo[3.3.1]nonane
SpectraBase Compound ID P6OeHqq2Zf
InChI InChI=1S/C12H17F3O3/c1-7-6-17-9-5-8(7)3-4-11(9,2)18-10(16)12(13,14)15/h7-9H,3-6H2,1-2H3/t7-,8-,9-,11-/m1/s1
InChIKey VTRBLGXKYMPDJU-TURQNECASA-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 77KPFDxS1n
Name (1R,4S,5R,8R)-4,8-dimethyl-8-trifluoroacetoxy-2-oxabicyclo[3.3.1]nonane
Alternate Name(s) (1R,4S,5R,8R)-4,8-dimethyl-2-oxabicyclo[3.3.1]non-8-yl trifluoroacetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H17F3O3
InChI InChI=1S/C12H17F3O3/c1-7-6-17-9-5-8(7)3-4-11(9,2)18-10(16)12(13,14)15/h7-9H,3-6H2,1-2H3/t7-,8-,9-,11-/m1/s1
InChIKey VTRBLGXKYMPDJU-TURQNECASA-N
Molecular Weight 266.260 g/mol
SMILES C(C(O[C@]1([C@@]2(OC[C@]([C@@](CC1)([H])C2)(C)[H])[H])C)=O)(F)(F)F
SPLASH splash10-0005-9100000000-1cad271a79f80c057afe
Source of Spectrum B-48-1301-0
Wiley ID 1269591