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4-Benzyl-1-{4-[(2,2,3,3-tetrafluoropropoxy)methyl]benzoyl}piperidine

View entire compound with spectra: 2 NMR

4-Benzyl-1-{4-[(2,2,3,3-tetrafluoropropoxy)methyl]benzoyl}piperidine
SpectraBase Compound ID 48LLpYreUS5
InChI InChI=1S/C23H25F4NO2/c24-22(25)23(26,27)16-30-15-19-6-8-20(9-7-19)21(29)28-12-10-18(11-13-28)14-17-4-2-1-3-5-17/h1-9,18,22H,10-16H2
InChIKey DOYQMUHOSWAUFJ-UHFFFAOYSA-N
Mol Weight 423.45 g/mol
Molecular Formula C23H25F4NO2
Exact Mass 423.182142 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 12FD9TIkE9y
Name 4-Benzyl-1-{4-[(2,2,3,3-tetrafluoropropoxy)methyl]benzoyl}piperidine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 423.182141699 u
Formula C23H25F4NO2
InChI InChI=1S/C23H25F4NO2/c24-22(25)23(26,27)16-30-15-19-6-8-20(9-7-19)21(29)28-12-10-18(11-13-28)14-17-4-2-1-3-5-17/h1-9,18,22H,10-16H2
InChIKey DOYQMUHOSWAUFJ-UHFFFAOYSA-N
Molecular Weight 423.452 g/mol
SMILES C(C(F)F)(F)(F)COCC=1C=CC(C(N2CCC(CC=3C=CC=CC3)CC2)=O)=CC1