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N-(3-Fluorophenyl)-N-(2-chlorobenzyl)-1-(2-phenylethyl)piperidin-4-amine
SpectraBase Compound ID ExHL5sV4Wrn
InChI InChI=1S/C26H28ClFN2/c27-26-12-5-4-9-22(26)20-30(25-11-6-10-23(28)19-25)24-14-17-29(18-15-24)16-13-21-7-2-1-3-8-21/h1-12,19,24H,13-18,20H2
InChIKey QIABRGVFNQFVME-UHFFFAOYSA-N
Mol Weight 422.98 g/mol
Molecular Formula C26H28ClFN2
Exact Mass 422.192505 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KIXNaNBpFzB
Name N-(3-Fluorophenyl)-N-(2-chlorobenzyl)-1-(2-phenylethyl)piperidin-4-amine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 422.192504773 u
Formula C26H28ClFN2
InChI InChI=1S/C26H28ClFN2/c27-26-12-5-4-9-22(26)20-30(25-11-6-10-23(28)19-25)24-14-17-29(18-15-24)16-13-21-7-2-1-3-8-21/h1-12,19,24H,13-18,20H2
InChIKey QIABRGVFNQFVME-UHFFFAOYSA-N
Molecular Weight 422.975 g/mol
SMILES C1(N(C2CCN(CC2)CCC=2C=CC=CC2)CC=2C(=CC=CC2)Cl)=CC(=CC=C1)F