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1-[[(4-chlorobenzoyl)amino]methyl]isonipecotic acid ethyl ester
SpectraBase Compound ID 4Dcvc7xnRFL
InChI InChI=1S/C16H21ClN2O3/c1-2-22-16(21)13-7-9-19(10-8-13)11-18-15(20)12-3-5-14(17)6-4-12/h3-6,13H,2,7-11H2,1H3,(H,18,20)
InChIKey PNFFOKIXQYLJTE-UHFFFAOYSA-N
Mol Weight 324.81 g/mol
Molecular Formula C16H21ClN2O3
Exact Mass 324.12407 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6PB5FXfUcDB
Name 4-piperidinecarboxylic acid, 1-[[(4-chlorobenzoyl)amino]methyl]-,ethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 324.124070241 u
Formula C16H21ClN2O3
InChI InChI=1S/C16H21ClN2O3/c1-2-22-16(21)13-7-9-19(10-8-13)11-18-15(20)12-3-5-14(17)6-4-12/h3-6,13H,2,7-11H2,1H3,(H,18,20)
InChIKey PNFFOKIXQYLJTE-UHFFFAOYSA-N
Molecular Weight 324.808 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_10195
Solvent DMSO-d6
Source Vendor ID: NMR/10241459; Lab Info: LP; Lab Number: LP-0103020