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3-Cyclohexyl-1,1,1-trifluoropropan-2-one
SpectraBase Compound ID CWe04iZE2l5
InChI InChI=1S/C9H13F3O/c10-9(11,12)8(13)6-7-4-2-1-3-5-7/h7H,1-6H2
InChIKey KHUKBKZRTMEANV-UHFFFAOYSA-N
Mol Weight 194.2 g/mol
Molecular Formula C9H13F3O
Exact Mass 194.09185 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IpKi1hbnPJR
Name 3-Cyclohexyl-1,1,1-trifluoropropan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H13F3O
InChI InChI=1S/C9H13F3O/c10-9(11,12)8(13)6-7-4-2-1-3-5-7/h7H,1-6H2
InChIKey KHUKBKZRTMEANV-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo301477s
Molecular Weight 194.197 g/mol
SMILES C1CCC(CC(C(F)(F)F)=O)CC1
SPLASH splash10-05rs-9200000000-5fcd335ed947d15eeb2c
Source of Spectrum J-77-8139-3n
Synonyms 3-Cyclohexyl-1,1,1-trifluoro-2-propanone 3-Cyclohexyl-1,1,1-trifluoro-propan-2-one 3-Cyclohexyl-1,1,1-tris(fluoranyl)propan-2-one
Wiley ID 1745283