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2,2,2-Trifluoro-N-(1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl)-N-phenylacetamide
SpectraBase Compound ID KCIynoIeg6q
InChI InChI=1S/C21H22F4N2O/c22-17-8-6-16(7-9-17)10-13-26-14-11-19(12-15-26)27(20(28)21(23,24)25)18-4-2-1-3-5-18/h1-9,19H,10-15H2
InChIKey ZOYSCHRCFTUZON-UHFFFAOYSA-N
Mol Weight 394.41 g/mol
Molecular Formula C21H22F4N2O
Exact Mass 394.166826 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6zhBlKUekss
Name 2,2,2-Trifluoro-N-(1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl)-N-phenylacetamide
Comments Computed using HOSE algorithm
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Exact Mass 394.166825987 u
Formula C21H22F4N2O
InChI InChI=1S/C21H22F4N2O/c22-17-8-6-16(7-9-17)10-13-26-14-11-19(12-15-26)27(20(28)21(23,24)25)18-4-2-1-3-5-18/h1-9,19H,10-15H2
InChIKey ZOYSCHRCFTUZON-UHFFFAOYSA-N
Molecular Weight 394.414 g/mol
SMILES C(N(C1CCN(CC1)CCC1=CC=C(C=C1)F)C1=CC=CC=C1)(C(F)(F)F)=O