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1,4-bis(trifluoromethyl)-2,3-bis(p-acetoxyphenyl)butane
SpectraBase Compound ID Fdur1pAFcwP
InChI InChI=1S/C22H20F6O4/c1-13(29)31-17-7-3-15(4-8-17)19(11-21(23,24)25)20(12-22(26,27)28)16-5-9-18(10-6-16)32-14(2)30/h3-10,19-20H,11-12H2,1-2H3
InChIKey WAQCNPZYBJRMSG-UHFFFAOYSA-N
Mol Weight 462.39 g/mol
Molecular Formula C22H20F6O4
Exact Mass 462.126578 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DRLx3CW9uhS
Name 1,4-bis(trifluoromethyl)-2,3-bis(p-acetoxyphenyl)butane
Appearance Yellow solid
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Formula C22H20F6O4
InChI InChI=1S/C22H20F6O4/c1-13(29)31-17-7-3-15(4-8-17)19(11-21(23,24)25)20(12-22(26,27)28)16-5-9-18(10-6-16)32-14(2)30/h3-10,19-20H,11-12H2,1-2H3
InChIKey WAQCNPZYBJRMSG-UHFFFAOYSA-N
Ionization Type EI positive ion
Literature Reference DOI 10.1002/adsc.202100828
Molecular Weight 462.388 g/mol
Reported Formula C22H20F6O4
SMILES c1cc(ccc1OC(C)=O)C(CC(F)(F)F)C(c1ccc(cc1)OC(C)=O)CC(F)(F)F
SPLASH splash10-000i-0910000000-7e02b866eb1adbd80751
Source of Spectrum ASC-364-SM34-2d
Wiley ID 1875159