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1-[2-(4-Fluorophenyl)ethyl]-N-(2-fluorobenzyl)-N-phenylpiperidin-4-amine
SpectraBase Compound ID Bpkv4cN4R6d
InChI InChI=1S/C26H28F2N2/c27-23-12-10-21(11-13-23)14-17-29-18-15-25(16-19-29)30(24-7-2-1-3-8-24)20-22-6-4-5-9-26(22)28/h1-13,25H,14-20H2
InChIKey WLVSRCFCTLFOEH-UHFFFAOYSA-N
Mol Weight 406.52 g/mol
Molecular Formula C26H28F2N2
Exact Mass 406.222055 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Lw9SLISVBEY
Name 1-[2-(4-Fluorophenyl)ethyl]-N-(2-fluorobenzyl)-N-phenylpiperidin-4-amine
Comments Computed using HOSE algorithm
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Exact Mass 406.222055236 u
Formula C26H28F2N2
InChI InChI=1S/C26H28F2N2/c27-23-12-10-21(11-13-23)14-17-29-18-15-25(16-19-29)30(24-7-2-1-3-8-24)20-22-6-4-5-9-26(22)28/h1-13,25H,14-20H2
InChIKey WLVSRCFCTLFOEH-UHFFFAOYSA-N
Molecular Weight 406.521 g/mol
SMILES C1(N(C=2C=CC=CC2)CC=2C(=CC=CC2)F)CCN(CC1)CCC1=CC=C(C=C1)F