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3-[4-(Trifluoromethyl)phenyl]cycloheptanone
SpectraBase Compound ID 6RVVGWtRasS
InChI InChI=1S/C14H15F3O/c15-14(16,17)12-7-5-10(6-8-12)11-3-1-2-4-13(18)9-11/h5-8,11H,1-4,9H2
InChIKey ZWENMTVITMFMQH-UHFFFAOYSA-N
Mol Weight 256.27 g/mol
Molecular Formula C14H15F3O
Exact Mass 256.1075 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 71TzQrvFKc2
Name 3-[4-(Trifluoromethyl)phenyl]cycloheptanone
Alternate Name(s) 3-[4-(trifluoromethyl)phenyl]-1-cycloheptanone
Comments Less than 3 mono-isotopic peaks
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Formula C14H15F3O
InChI InChI=1S/C14H15F3O/c15-14(16,17)12-7-5-10(6-8-12)11-3-1-2-4-13(18)9-11/h5-8,11H,1-4,9H2
InChIKey ZWENMTVITMFMQH-UHFFFAOYSA-N
Molecular Weight 256.268 g/mol
SMILES C(c1ccc(C2CC(=O)CCCC2)cc1)(F)(F)F
SPLASH splash10-052b-0970000000-85be87ada5969d358b42
Source of Spectrum F-68-1609-8b
Wiley ID 1707749