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3-[4-(Trifluoromethyl)phenyl]cyclohexanone
SpectraBase Compound ID L1hjlX0TlWF
InChI InChI=1S/C13H13F3O/c14-13(15,16)11-6-4-9(5-7-11)10-2-1-3-12(17)8-10/h4-7,10H,1-3,8H2
InChIKey PXEDGGLZDRNQLK-UHFFFAOYSA-N
Mol Weight 242.24 g/mol
Molecular Formula C13H13F3O
Exact Mass 242.09185 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L7A7gMNCHOw
Name 3-[4-(Trifluoromethyl)phenyl]cyclohexanone
Alternate Name(s) 3-[4-(trifluoromethyl)phenyl]-1-cyclohexanone
Comments Less than 3 mono-isotopic peaks
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Formula C13H13F3O
InChI InChI=1S/C13H13F3O/c14-13(15,16)11-6-4-9(5-7-11)10-2-1-3-12(17)8-10/h4-7,10H,1-3,8H2
InChIKey PXEDGGLZDRNQLK-UHFFFAOYSA-N
Molecular Weight 242.241 g/mol
SMILES C(c1ccc(C2CC(=O)CCC2)cc1)(F)(F)F
SPLASH splash10-0005-0980000000-adb5f31283328cef80d9
Source of Spectrum F-68-1609-2b
Wiley ID 1707756