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(4-phenylstyryl)(trifluoromethyl)sulfane
SpectraBase Compound ID BIfXrLZkb4j
InChI InChI=1S/C15H11F3S/c16-15(17,18)19-11-10-12-6-8-14(9-7-12)13-4-2-1-3-5-13/h1-11H
InChIKey OHZWBHBEYYGFAA-UHFFFAOYSA-N
Mol Weight 280.31 g/mol
Molecular Formula C15H11F3S
Exact Mass 280.053356 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jkkkqn4jHCE
Name (4-phenylstyryl)(trifluoromethyl)sulfane
Appearance White solid
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Exact Mass 280.053356017 u
Formula C15H11F3S
GC Column HP-5MS (30 m x 0.25 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 320oC
InChI InChI=1S/C15H11F3S/c16-15(17,18)19-11-10-12-6-8-14(9-7-12)13-4-2-1-3-5-13/h1-11H
InChIKey OHZWBHBEYYGFAA-UHFFFAOYSA-N
Instrument Name Agilent Technologies 7890A-5975C VL or Agilent 5975
Ionization Type EI
Literature Reference DOI 10.1002/chem.201600190
Molecular Weight 280.308 g/mol
Quality 1
Reported Formula C15H11SF3
SMILES C1(=CC=C(C=C1)C1=CC=CC=C1)C=CSC(F)(F)F
SPLASH splash10-003r-0390000000-bea816d67725a07eff82
Sample Comments Major isomer, E/Z = 70:30
Source of Spectrum QE-22-SM23-3o (DOI: 10.1002/chem.201600190)
Thin-Layer Chromatography 0.48 (DCM/n-pentane, 3%)
Wiley ID 1903053