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3-[2-(Trifluoromethyl)phenyl]chroman-4-one
SpectraBase Compound ID BoFj8Ui7MyJ
InChI InChI=1S/C16H11F3O2/c17-16(18,19)13-7-3-1-5-10(13)12-9-21-14-8-4-2-6-11(14)15(12)20/h1-8,12H,9H2
InChIKey UJBFPDWRWXFNPL-UHFFFAOYSA-N
Mol Weight 292.26 g/mol
Molecular Formula C16H11F3O2
Exact Mass 292.071114 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID vBxOrrWlSs
Name 3-[2-(Trifluoromethyl)phenyl]chroman-4-one
Alternate Name(s) 3-[2-(trifluoromethyl)phenyl]-3,4-dihydro-2H-1-benzopyran-4-one
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Formula C16H11F3O2
InChI InChI=1S/C16H11F3O2/c17-16(18,19)13-7-3-1-5-10(13)12-9-21-14-8-4-2-6-11(14)15(12)20/h1-8,12H,9H2
InChIKey UJBFPDWRWXFNPL-UHFFFAOYSA-N
Molecular Weight 292.257 g/mol
SMILES C1(C(c2ccccc2OC1)=O)c1c(C(F)(F)F)cccc1
SPLASH splash10-00dl-2930000000-dc84421c9948356c6bda
Source of Spectrum U1-2010-1342-3e
Wiley ID 1663496