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N-(4-benzhydryl-1-piperazinyl)-N-[(E)-(2-fluorophenyl)methylidene]amine
SpectraBase Compound ID An1JiIA9ACA
InChI InChI=1S/C24H24FN3/c25-23-14-8-7-13-22(23)19-26-28-17-15-27(16-18-28)24(20-9-3-1-4-10-20)21-11-5-2-6-12-21/h1-14,19,24H,15-18H2/b26-19+
InChIKey VPNLYLUYXLCDOF-LGUFXXKBSA-N
Mol Weight 373.48 g/mol
Molecular Formula C24H24FN3
Exact Mass 373.195426 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Hz5gnoc5EMG
Name N-(4-Benzhydryl-1-piperazinyl)-N-[(E)-(2-fluorophenyl)methylidene]amine
Comments Computed using HOSE algorithm
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Exact Mass 373.195425948 u
Formula C24H24FN3
InChI InChI=1S/C24H24FN3/c25-23-14-8-7-13-22(23)19-26-28-17-15-27(16-18-28)24(20-9-3-1-4-10-20)21-11-5-2-6-12-21/h1-14,19,24H,15-18H2/b26-19+
InChIKey VPNLYLUYXLCDOF-LGUFXXKBSA-N
Molecular Weight 373.475 g/mol
SMILES C=1C=CC(C(N2CCN(CC2)\N=C\C=2C(F)=CC=CC2)C2=CC=CC=C2)=CC1