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5,6,7,8,9,9-Hexafluoro-2-phenyl-4-trifluoromethyl-1,3-diazafluorene

View entire compound with spectra: 2 NMR

5,6,7,8,9,9-Hexafluoro-2-phenyl-4-trifluoromethyl-1,3-diazafluorene
SpectraBase Compound ID 4GCHhzF2IN8
InChI InChI=1S/C18H5F9N2/c19-10-7-8-14(17(23,24)9(7)11(20)13(22)12(10)21)28-16(6-4-2-1-3-5-6)29-15(8)18(25,26)27/h1-5H
InChIKey ZJCLAIZDJRBXHE-UHFFFAOYSA-N
Mol Weight 420.24 g/mol
Molecular Formula C18H5F9N2
Exact Mass 420.030902 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9hbLZn5jOYv
Name 5,6,7,8,9,9-Hexafluoro-2-phenyl-4-trifluoromethyl-1,3-diazafluorene
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 420.030901636 u
Formula C18H5F9N2
InChI InChI=1S/C18H5F9N2/c19-10-7-8-14(17(23,24)9(7)11(20)13(22)12(10)21)28-16(6-4-2-1-3-5-6)29-15(8)18(25,26)27/h1-5H
InChIKey ZJCLAIZDJRBXHE-UHFFFAOYSA-N
Molecular Weight 420.238 g/mol
SMILES C1(=NC=2C(C3=C(C(=C(C(=C3C2C(=N1)C(F)(F)F)F)F)F)F)(F)F)C1=CC=CC=C1