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3-(4-Fluorophenyl)-1-phenyl-1H-pyrazol-5-ylamine, 2tms

View entire compound with spectra: 1 NMR

3-(4-Fluorophenyl)-1-phenyl-1H-pyrazol-5-ylamine, 2tms
SpectraBase Compound ID 6DKKIjPqL0P
InChI InChI=1S/C21H28FN3Si2/c1-26(2,3)25(27(4,5)6)21-16-20(17-12-14-18(22)15-13-17)23-24(21)19-10-8-7-9-11-19/h7-16H,1-6H3
InChIKey IZMNESRXQHOHFV-UHFFFAOYSA-N
Mol Weight 397.64 g/mol
Molecular Formula C21H28FN3Si2
Exact Mass 397.180579 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BoFij3d67tL
Name 3-(4-Fluorophenyl)-1-phenyl-1H-pyrazol-5-ylamine, 2tms
Comments Computed using HOSE algorithm
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Exact Mass 397.180579147 u
Formula C21H28FN3Si2
InChI InChI=1S/C21H28FN3Si2/c1-26(2,3)25(27(4,5)6)21-16-20(17-12-14-18(22)15-13-17)23-24(21)19-10-8-7-9-11-19/h7-16H,1-6H3
InChIKey IZMNESRXQHOHFV-UHFFFAOYSA-N
Molecular Weight 397.644 g/mol
SMILES C1(F)=CC=C(C=C1)C1=NN(C(=C1)N([Si](C)(C)C)[Si](C)(C)C)C1=CC=CC=C1