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

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1,3,5-Triazine-2,4,6-triamine, N',N''-bis(2,6-difluorophenyl)-N,N-dihexyl-
SpectraBase Compound ID 9wgMzbFz8lz
InChI InChI=1S/C27H34F4N6/c1-3-5-7-9-17-37(18-10-8-6-4-2)27-35-25(32-23-19(28)13-11-14-20(23)29)34-26(36-27)33-24-21(30)15-12-16-22(24)31/h11-16H,3-10,17-18H2,1-2H3,(H2,32,33,34,35,36)
InChIKey JQTDNYIBFMGIQH-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 JePrzfHQfW8
Name 1,3,5-Triazine-2,4,6-triamine, N',N''-bis(2,6-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/c1-3-5-7-9-17-37(18-10-8-6-4-2)27-35-25(32-23-19(28)13-11-14-20(23)29)34-26(36-27)33-24-21(30)15-12-16-22(24)31/h11-16H,3-10,17-18H2,1-2H3,(H2,32,33,34,35,36)
InChIKey JQTDNYIBFMGIQH-UHFFFAOYSA-N
Molecular Weight 518.605 g/mol
SMILES C1(=NC(=NC(=N1)NC1=C(C=CC=C1F)F)N(CCCCCC)CCCCCC)NC1=C(C=CC=C1F)F