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3,5-bis(4-fluorophenyl)-1-(4-vinylbenzyl)-1H-pyrazole
SpectraBase Compound ID KXSXqZuOfsU
InChI InChI=1S/C24H18F2N2/c1-2-17-3-5-18(6-4-17)16-28-24(20-9-13-22(26)14-10-20)15-23(27-28)19-7-11-21(25)12-8-19/h2-15H,1,16H2
InChIKey ZKEOUVLOXXIKOB-UHFFFAOYSA-N
Mol Weight 372.42 g/mol
Molecular Formula C24H18F2N2
Exact Mass 372.143805 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FmOxBJgFIni
Name 3,5-bis(4-Fluorophenyl)-1-(4-vinylbenzyl)-1H-pyrazole
Comments Computed using HOSE algorithm
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Exact Mass 372.143804914 u
Formula C24H18F2N2
InChI InChI=1S/C24H18F2N2/c1-2-17-3-5-18(6-4-17)16-28-24(20-9-13-22(26)14-10-20)15-23(27-28)19-7-11-21(25)12-8-19/h2-15H,1,16H2
InChIKey ZKEOUVLOXXIKOB-UHFFFAOYSA-N
Molecular Weight 372.419 g/mol
SMILES C(C1=CC=C(C=C)C=C1)N1N=C(C=2C=CC(=CC2)F)C=C1C1=CC=C(F)C=C1