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2-Bromo-3,5-difluoro-4-[1,2,2,2-tetrafluoro-1-trifluoromethyl-ethyl]-6-{3,5,6-trifluoro-4-[1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl](2-pyridyl)}pyridine
SpectraBase Compound ID CmiR6Kjcnwa
InChI InChI=1S/C16BrF19N2/c17-9-5(20)1(11(23,13(25,26)27)14(28,29)30)3(18)7(37-9)8-4(19)2(6(21)10(22)38-8)12(24,15(31,32)33)16(34,35)36
InChIKey PUPDTLFDHXNATP-UHFFFAOYSA-N
Mol Weight 661.06 g/mol
Molecular Formula C16BrF19N2
Exact Mass 659.894146 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IZDjUoJtJwT
Name 2-Bromo-3,5-difluoro-4-[1,2,2,2-tetrafluoro-1-trifluoromethyl-ethyl]-6-{3,5,6-trifluoro-4-[1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl](2-pyridyl)}pyridine
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 659.894146105 u
Formula C16BrF19N2
GC Column HP1 (25m)
InChI InChI=1S/C16BrF19N2/c17-9-5(20)1(11(23,13(25,26)27)14(28,29)30)3(18)7(37-9)8-4(19)2(6(21)10(22)38-8)12(24,15(31,32)33)16(34,35)36
InChIKey PUPDTLFDHXNATP-UHFFFAOYSA-N
Instrument Name Fisons VG-Trio 1000-Hewlett Packard 5890 series II
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0003.624
Molecular Weight 661.064 g/mol
Quality 104
SMILES C=1(C(=C(C(=NC1C=1C(=C(C(=C(F)N1)F)C(C(F)(F)F)(F)C(F)(F)F)F)Br)F)C(C(F)(F)F)(F)C(F)(F)F)F
SPLASH splash10-014i-9000001000-b9698d7956642841cb22
Source of Spectrum ARK-2002-282-5 (DOI: 10.3998/ark.5550190.0003.624)
Wiley ID 1904750