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2-(4-benzyl-1-piperidinyl)-1-(5-fluoro-1H-indol-3-yl)ethanone
SpectraBase Compound ID AGIYYAMGj0k
InChI InChI=1S/C22H23FN2O/c23-18-6-7-21-19(13-18)20(14-24-21)22(26)15-25-10-8-17(9-11-25)12-16-4-2-1-3-5-16/h1-7,13-14,17,24H,8-12,15H2
InChIKey JTEXMZUWQKFDDU-UHFFFAOYSA-N
Mol Weight 350.44 g/mol
Molecular Formula C22H23FN2O
Exact Mass 350.179442 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 57x5712eqvb
Name 2-(4-Benzyl-1-piperidinyl)-1-(5-fluoro-1H-indol-3-yl)ethanone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 350.179441531 u
Formula C22H23FN2O
InChI InChI=1S/C22H23FN2O/c23-18-6-7-21-19(13-18)20(14-24-21)22(26)15-25-10-8-17(9-11-25)12-16-4-2-1-3-5-16/h1-7,13-14,17,24H,8-12,15H2
InChIKey JTEXMZUWQKFDDU-UHFFFAOYSA-N
Molecular Weight 350.437 g/mol
SMILES N1C=2C(C(=C1)C(CN1CCC(CC3=CC=CC=C3)CC1)=O)=CC(=CC2)F