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(4-(tert-butyl)phenyl)(4-(trifluoromethyl)phenyl)methanone
SpectraBase Compound ID BQvIW1DBDuL
InChI InChI=1S/C18H17F3O/c1-17(2,3)14-8-4-12(5-9-14)16(22)13-6-10-15(11-7-13)18(19,20)21/h4-11H,1-3H3
InChIKey JPJYSDOXYOZRPH-UHFFFAOYSA-N
Mol Weight 306.33 g/mol
Molecular Formula C18H17F3O
Exact Mass 306.12315 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9vbBQqunXon
Name (4-(tert-butyl)phenyl)(4-(trifluoromethyl)phenyl)methanone
Appearance White solid
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Exact Mass 306.123149655 u
Formula C18H17F3O
InChI InChI=1S/C18H17F3O/c1-17(2,3)14-8-4-12(5-9-14)16(22)13-6-10-15(11-7-13)18(19,20)21/h4-11H,1-3H3
InChIKey JPJYSDOXYOZRPH-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/chem.201605139
Molecular Weight 306.328 g/mol
Quality 21
Reported Formula C18H17F3O
SMILES C=1C(=CC=C(C1)C(C1=CC=C(C=C1)C(C)(C)C)=O)C(F)(F)F
SPLASH splash10-03di-0910000000-852fa36e9aa8ba38d525
Source of Spectrum QE-23-SM17-4f (DOI: 10.1002/chem.201605139)
Thin-Layer Chromatography 0.30 (SiO2, i-hexane/EtOAc,19:1)
Wiley ID 1903804