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1-phenyl-2-(4-(trifluoromethyl)phenyl)ethyl benzoate
SpectraBase Compound ID F4h1TGd7C8y
InChI InChI=1S/C22H17F3O2/c23-22(24,25)19-13-11-16(12-14-19)15-20(17-7-3-1-4-8-17)27-21(26)18-9-5-2-6-10-18/h1-14,20H,15H2
InChIKey CLJOAOSRPCOCEH-UHFFFAOYSA-N
Mol Weight 370.37 g/mol
Molecular Formula C22H17F3O2
Exact Mass 370.118064 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8czaOJi7a6
Name 1-phenyl-2-(4-(trifluoromethyl)phenyl)ethyl benzoate
Appearance Colorless solid
Carrier Gas Methane
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Exact Mass 370.118064274 u
Formula C22H17F3O2
InChI InChI=1S/C22H17F3O2/c23-22(24,25)19-13-11-16(12-14-19)15-20(17-7-3-1-4-8-17)27-21(26)18-9-5-2-6-10-18/h1-14,20H,15H2
InChIKey CLJOAOSRPCOCEH-UHFFFAOYSA-N
Ionization Type EI Positive ion
Literature Reference DOI 10.1002/chem.202201761
Molecular Weight 370.371 g/mol
Quality 139
Reported Formula C22H17O2F3
SMILES C1(=CC=CC=C1)C(CC1=CC=C(C=C1)C(F)(F)F)OC(C1=CC=CC=C1)=O
SPLASH splash10-0a4i-2920000000-c13c9496e738fa1c1f78
Source of Spectrum QE-28-SM37-7f (DOI: 10.1002/chem.202201761)
Thin-Layer Chromatography 0.32 (n-pentane/EtOAc, 20:1)
Wiley ID 1900716