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4-Propyl-2,6-bis(trifluoroacetyl)phenol
SpectraBase Compound ID LvppULbBz4K
InChI InChI=1S/C13H10F6O3/c1-2-3-6-4-7(10(21)12(14,15)16)9(20)8(5-6)11(22)13(17,18)19/h4-5,20H,2-3H2,1H3
InChIKey KPYPEJGEALQXSK-UHFFFAOYSA-N
Mol Weight 328.21 g/mol
Molecular Formula C13H10F6O3
Exact Mass 328.053413 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 29ztTErETF0
Name 4-Propyl-2,6-bis(trifluoroacetyl)phenol
Alternate Name(s) 2,2,2-trifluoro-1-[2-hydroxy-5-propyl-3-(2,2,2-trifluoro-1-oxoethyl)phenyl]ethanone 2,2,2-tris(fluoranyl)-1-[2-oxidanyl-5-propyl-3-[2,2,2-tris(fluoranyl)ethanoyl]phenyl]ethanone
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Formula C13H10F6O3
InChI InChI=1S/C13H10F6O3/c1-2-3-6-4-7(10(21)12(14,15)16)9(20)8(5-6)11(22)13(17,18)19/h4-5,20H,2-3H2,1H3
InChIKey KPYPEJGEALQXSK-UHFFFAOYSA-N
Molecular Weight 328.210 g/mol
SMILES Oc1c(C(C(F)(F)F)=O)cc(cc1C(C(F)(F)F)=O)CCC
SPLASH splash10-0a4i-0091000000-bf7a1568b092df021da5
Source of Spectrum F4-40-1873-3c
Wiley ID 1670779