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1,1,1-trifluoro-5,5-dimethylhexan-2-one
SpectraBase Compound ID AZK9Ac9eflu
InChI InChI=1S/C8H13F3O/c1-7(2,3)5-4-6(12)8(9,10)11/h4-5H2,1-3H3
InChIKey XEBVOFICFXBMBG-UHFFFAOYSA-N
Mol Weight 182.19 g/mol
Molecular Formula C8H13F3O
Exact Mass 182.09185 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DECGdvS7mwM
Name 1,1,1-trifluoro-5,5-dimethylhexan-2-one
Alternate Name(s) 1,1,1-trifluoro-5,5-dimethyl-2-hexanone 1,1,1-tris(fluoranyl)-5,5-dimethyl-hexan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H13F3O
InChI InChI=1S/C8H13F3O/c1-7(2,3)5-4-6(12)8(9,10)11/h4-5H2,1-3H3
InChIKey XEBVOFICFXBMBG-UHFFFAOYSA-N
Literature Reference DOI 10.1039/c4sc01732c
Molecular Weight 182.186 g/mol
SMILES C(CC(C)(C)C)C(=O)C(F)(F)F
SPLASH splash10-0a4i-9400000000-381a2103c5e88119241a
Source of Spectrum CSS-5-3983/SMS13-15
Wiley ID 1755056