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4-Piperidinecarboxylic acid, 1-[3-[(3,4-difluorophenyl)amino]-3-oxopropyl]-, ethyl ester

View entire compound with spectra: 2 NMR

4-Piperidinecarboxylic acid, 1-[3-[(3,4-difluorophenyl)amino]-3-oxopropyl]-, ethyl ester
SpectraBase Compound ID 7mCIVFsgp6V
InChI InChI=1S/C17H22F2N2O3/c1-2-24-17(23)12-5-8-21(9-6-12)10-7-16(22)20-13-3-4-14(18)15(19)11-13/h3-4,11-12H,2,5-10H2,1H3,(H,20,22)
InChIKey HJCKSXVTNQDGGU-UHFFFAOYSA-N
Mol Weight 340.37 g/mol
Molecular Formula C17H22F2N2O3
Exact Mass 340.159849 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KBMA3uA7Z
Name 4-Piperidinecarboxylic acid, 1-[3-[(3,4-difluorophenyl)amino]-3-oxopropyl]-, ethyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 340.159848899 u
Formula C17H22F2N2O3
InChI InChI=1S/C17H22F2N2O3/c1-2-24-17(23)12-5-8-21(9-6-12)10-7-16(22)20-13-3-4-14(18)15(19)11-13/h3-4,11-12H,2,5-10H2,1H3,(H,20,22)
InChIKey HJCKSXVTNQDGGU-UHFFFAOYSA-N
Molecular Weight 340.371 g/mol
SMILES N(C(CCN1CCC(C(=O)OCC)CC1)=O)C=1C=C(F)C(=CC1)F