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Tetrahydro-4-[4-(trifluoromethyl)phenyl]-2H-pyran-2-one
SpectraBase Compound ID JciYarepwhv
InChI InChI=1S/C12H11F3O2/c13-12(14,15)10-3-1-8(2-4-10)9-5-6-17-11(16)7-9/h1-4,9H,5-7H2
InChIKey MTTWHDVDTMAVRC-UHFFFAOYSA-N
Mol Weight 244.21 g/mol
Molecular Formula C12H11F3O2
Exact Mass 244.071114 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Ae76kVv0q
Name Tetrahydro-4-[4-(trifluoromethyl)phenyl]-2H-pyran-2-one
Alternate Name(s) 4-[4-(trifluoromethyl)phenyl]-2-oxanone 4-[4-(trifluoromethyl)phenyl]oxan-2-one
Comments Less than 3 mono-isotopic peaks
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Formula C12H11F3O2
InChI InChI=1S/C12H11F3O2/c13-12(14,15)10-3-1-8(2-4-10)9-5-6-17-11(16)7-9/h1-4,9H,5-7H2
InChIKey MTTWHDVDTMAVRC-UHFFFAOYSA-N
Molecular Weight 244.213 g/mol
SMILES C(c1ccc(C2CC(=O)OCC2)cc1)(F)(F)F
SPLASH splash10-00dl-0890000000-4a0d903bf872b6de4d36
Source of Spectrum F-68-1610-10b
Wiley ID 1707745