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1-Benzyl-N-(3-fluorophenyl)-N-([3-(trifluoromethyl)phenyl]methyl)piperidin-4-amine
SpectraBase Compound ID SL0X7ADAzb
InChI InChI=1S/C26H26F4N2/c27-23-10-5-11-25(17-23)32(19-21-8-4-9-22(16-21)26(28,29)30)24-12-14-31(15-13-24)18-20-6-2-1-3-7-20/h1-11,16-17,24H,12-15,18-19H2
InChIKey LGBRSEXMYAGTDU-UHFFFAOYSA-N
Mol Weight 442.5 g/mol
Molecular Formula C26H26F4N2
Exact Mass 442.203211 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 74AliOrtmQ0
Name 1-Benzyl-N-(3-fluorophenyl)-N-([3-(trifluoromethyl)phenyl]methyl)piperidin-4-amine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 442.203211497 u
Formula C26H26F4N2
InChI InChI=1S/C26H26F4N2/c27-23-10-5-11-25(17-23)32(19-21-8-4-9-22(16-21)26(28,29)30)24-12-14-31(15-13-24)18-20-6-2-1-3-7-20/h1-11,16-17,24H,12-15,18-19H2
InChIKey LGBRSEXMYAGTDU-UHFFFAOYSA-N
Molecular Weight 442.502 g/mol
SMILES C1(N(C2CCN(CC=3C=CC=CC3)CC2)CC=2C=C(C(F)(F)F)C=CC2)=CC(=CC=C1)F