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N-[{4-(Tert-butyl)phenyl}(4-fluorophenyl)methyl]-3-methylpyridin-2-amine
SpectraBase Compound ID F8U8YezzEA8
InChI InChI=1S/C23H25FN2/c1-16-6-5-15-25-22(16)26-21(18-9-13-20(24)14-10-18)17-7-11-19(12-8-17)23(2,3)4/h5-15,21H,1-4H3,(H,25,26)
InChIKey RWZARBHVBBGUKJ-UHFFFAOYSA-N
Mol Weight 348.47 g/mol
Molecular Formula C23H25FN2
Exact Mass 348.200177 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6QK0s664cYF
Name N-[{4-(Tert-butyl)phenyl}(4-fluorophenyl)methyl]-3-methylpyridin-2-amine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 348.200176976 u
Formula C23H25FN2
InChI InChI=1S/C23H25FN2/c1-16-6-5-15-25-22(16)26-21(18-9-13-20(24)14-10-18)17-7-11-19(12-8-17)23(2,3)4/h5-15,21H,1-4H3,(H,25,26)
InChIKey RWZARBHVBBGUKJ-UHFFFAOYSA-N
Molecular Weight 348.465 g/mol
SMILES C1=CN=C(NC(C=2C=CC(=CC2)F)C2=CC=C(C=C2)C(C)(C)C)C(C)=C1