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N-(3-Fluorophenyl)-N-(1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl)-pent-4-enamide
SpectraBase Compound ID HAxAC827fqw
InChI InChI=1S/C24H28F2N2O/c1-2-3-7-24(29)28(23-6-4-5-21(26)18-23)22-13-16-27(17-14-22)15-12-19-8-10-20(25)11-9-19/h2,4-6,8-11,18,22H,1,3,7,12-17H2
InChIKey XFOUWJKVVXZVRQ-UHFFFAOYSA-N
Mol Weight 398.5 g/mol
Molecular Formula C24H28F2N2O
Exact Mass 398.21697 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9D6IWFFMqJE
Name N-(3-Fluorophenyl)-N-(1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl)-pent-4-enamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 398.216969855 u
Formula C24H28F2N2O
InChI InChI=1S/C24H28F2N2O/c1-2-3-7-24(29)28(23-6-4-5-21(26)18-23)22-13-16-27(17-14-22)15-12-19-8-10-20(25)11-9-19/h2,4-6,8-11,18,22H,1,3,7,12-17H2
InChIKey XFOUWJKVVXZVRQ-UHFFFAOYSA-N
Molecular Weight 398.498 g/mol
SMILES C1(N(C=2C=C(C=CC2)F)C(CCC=C)=O)CCN(CC1)CCC=1C=CC(=CC1)F