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1,3,5-Triazine-2,4,6-triamine, N',N''-bis(2,5-difluorophenyl)-N,N-dihexyl-

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1,3,5-Triazine-2,4,6-triamine, N',N''-bis(2,5-difluorophenyl)-N,N-dihexyl-
SpectraBase Compound ID 9YeRhdjCUKQ
InChI InChI=1S/C27H34F4N6/c1-3-5-7-9-15-37(16-10-8-6-4-2)27-35-25(32-23-17-19(28)11-13-21(23)30)34-26(36-27)33-24-18-20(29)12-14-22(24)31/h11-14,17-18H,3-10,15-16H2,1-2H3,(H2,32,33,34,35,36)
InChIKey HFKZAMNKGVXOTH-UHFFFAOYSA-N
Mol Weight 518.6 g/mol
Molecular Formula C27H34F4N6
Exact Mass 518.278108 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FWEtPFvnH1z
Name 1,3,5-Triazine-2,4,6-triamine, N',N''-bis(2,5-difluorophenyl)-N,N-dihexyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 518.278107771 u
Formula C27H34F4N6
InChI InChI=1S/C27H34F4N6/c1-3-5-7-9-15-37(16-10-8-6-4-2)27-35-25(32-23-17-19(28)11-13-21(23)30)34-26(36-27)33-24-18-20(29)12-14-22(24)31/h11-14,17-18H,3-10,15-16H2,1-2H3,(H2,32,33,34,35,36)
InChIKey HFKZAMNKGVXOTH-UHFFFAOYSA-N
Molecular Weight 518.605 g/mol
SMILES C1(=NC(=NC(=N1)NC1=C(C=CC(=C1)F)F)N(CCCCCC)CCCCCC)NC1=C(C=CC(=C1)F)F