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1-Adamantyl .alpha.-(trifluoromethyl)ethenyl ketone
SpectraBase Compound ID Vt9FiYwJIr
InChI InChI=1S/C14H17F3O/c1-8(14(15,16)17)12(18)13-5-9-2-10(6-13)4-11(3-9)7-13/h9-11H,1-7H2
InChIKey VGGDWQLCHUOXNS-UHFFFAOYSA-N
Mol Weight 258.28 g/mol
Molecular Formula C14H17F3O
Exact Mass 258.12315 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8wLNW7ZcLen
Name 1-Adamantyl .alpha.-(trifluoromethyl)ethenyl ketone
Alternate Name(s) 1-(1-adamantyl)-2-(trifluoromethyl)-2-propen-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C14H17F3O
InChI InChI=1S/C14H17F3O/c1-8(14(15,16)17)12(18)13-5-9-2-10(6-13)4-11(3-9)7-13/h9-11H,1-7H2
InChIKey VGGDWQLCHUOXNS-UHFFFAOYSA-N
Molecular Weight 258.284 g/mol
SMILES C(C(C12CC3CC(C2)CC(C1)C3)=O)(C(F)(F)F)=C
SPLASH splash10-000i-0900000000-088292bc7fe662aa2591
Source of Spectrum J-59-2641-4
Wiley ID 1261672