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2,2'-diiodo-5-trifluoromethyl-1,1'-biphenyl
SpectraBase Compound ID JFnMr3lIkIj
InChI InChI=1S/C13H7F3I2/c14-13(15,16)8-5-6-12(18)10(7-8)9-3-1-2-4-11(9)17/h1-7H
InChIKey SFKJHOAGLPCAKE-UHFFFAOYSA-N
Mol Weight 474.0 g/mol
Molecular Formula C13H7F3I2
Exact Mass 473.858925 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3TkoJX2efkf
Name 2,2'-diiodo-5-trifluoromethyl-1,1'-biphenyl
Appearance Yellow solid
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Formula C13H7F3I2
InChI InChI=1S/C13H7F3I2/c14-13(15,16)8-5-6-12(18)10(7-8)9-3-1-2-4-11(9)17/h1-7H
InChIKey SFKJHOAGLPCAKE-UHFFFAOYSA-N
Instrument Name Thermo Finnigan LTQ FT Ultra High Performance
Ionization Type EI
Literature Reference DOI 10.1002/anie.201908046
Molecular Weight 474.003 g/mol
Reported Formula C13H7F3I2
SMILES c1(I)c(cccc1)-c1c(ccc(c1)C(F)(F)F)I
SPLASH splash10-006t-0069000000-2fb254cc544517305f07
Source of Spectrum ACI-58-SM17-4h
Wiley ID 1875613