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1,4-bis(trifluoromethyl)-2,3-bis(p-toluyl)butane
SpectraBase Compound ID HadZ5DW89hk
InChI InChI=1S/C20H20F6/c1-13-3-7-15(8-4-13)17(11-19(21,22)23)18(12-20(24,25)26)16-9-5-14(2)6-10-16/h3-10,17-18H,11-12H2,1-2H3
InChIKey NMXNNROEKDVUAP-UHFFFAOYSA-N
Mol Weight 374.37 g/mol
Molecular Formula C20H20F6
Exact Mass 374.14692 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Krt1UNNm97s
Name 1,4-bis(trifluoromethyl)-2,3-bis(p-toluyl)butane
Appearance White solid
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Formula C20H20F6
InChI InChI=1S/C20H20F6/c1-13-3-7-15(8-4-13)17(11-19(21,22)23)18(12-20(24,25)26)16-9-5-14(2)6-10-16/h3-10,17-18H,11-12H2,1-2H3
InChIKey NMXNNROEKDVUAP-UHFFFAOYSA-N
Ionization Type EI positive ion
Literature Reference DOI 10.1002/adsc.202100828
Molecular Weight 374.370 g/mol
Reported Formula C20H20F6
SMILES c1cc(ccc1C)C(CC(F)(F)F)C(c1ccc(cc1)C)CC(F)(F)F
SPLASH splash10-0079-0900000000-b1b4e026627063669b84
Source of Spectrum ASC-364-SM22-2a
Wiley ID 1875156