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N-(2-Chlorobenzyl)-N-(4-fluorophenyl)-1-[2-(thiophen-2-yl)ethyl]piperidin-4-amine
SpectraBase Compound ID 3NNyRONFhbL
InChI InChI=1S/C24H26ClFN2S/c25-24-6-2-1-4-19(24)18-28(21-9-7-20(26)8-10-21)22-11-14-27(15-12-22)16-13-23-5-3-17-29-23/h1-10,17,22H,11-16,18H2
InChIKey DRJJFJOFYILJIC-UHFFFAOYSA-N
Mol Weight 429.0 g/mol
Molecular Formula C24H26ClFN2S
Exact Mass 428.148926 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I28fHJhzVD9
Name N-(2-Chlorobenzyl)-N-(4-fluorophenyl)-1-[2-(thiophen-2-yl)ethyl]piperidin-4-amine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 428.148925882 u
Formula C24H26ClFN2S
InChI InChI=1S/C24H26ClFN2S/c25-24-6-2-1-4-19(24)18-28(21-9-7-20(26)8-10-21)22-11-14-27(15-12-22)16-13-23-5-3-17-29-23/h1-10,17,22H,11-16,18H2
InChIKey DRJJFJOFYILJIC-UHFFFAOYSA-N
Molecular Weight 428.997 g/mol
SMILES C1(N(C2=CC=C(C=C2)F)CC=2C(=CC=CC2)Cl)CCN(CC1)CCC=1SC=CC1