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1-piperidinecarboxylic acid, 4-[1-(4-chlorophenyl)-4-[[(2,4-dimethylphenyl)amino]carbonyl]-1H-pyrazol-5-yl]-, 1,1-dimethylethyl ester

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1-piperidinecarboxylic acid, 4-[1-(4-chlorophenyl)-4-[[(2,4-dimethylphenyl)amino]carbonyl]-1H-pyrazol-5-yl]-, 1,1-dimethylethyl ester
SpectraBase Compound ID DU7SsgukGjN
InChI InChI=1S/C28H33ClN4O3/c1-18-6-11-24(19(2)16-18)31-26(34)23-17-30-33(22-9-7-21(29)8-10-22)25(23)20-12-14-32(15-13-20)27(35)36-28(3,4)5/h6-11,16-17,20H,12-15H2,1-5H3,(H,31,34)
InChIKey XTHHBYHKXSPJGB-UHFFFAOYSA-N
Mol Weight 509.1 g/mol
Molecular Formula C28H33ClN4O3
Exact Mass 508.224119 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GDlhWzNGQDo
Name 1-piperidinecarboxylic acid, 4-[1-(4-chlorophenyl)-4-[[(2,4-dimethylphenyl)amino]carbonyl]-1H-pyrazol-5-yl]-, 1,1-dimethylethyl 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 508.224118636 u
Formula C28H33ClN4O3
InChI InChI=1S/C28H33ClN4O3/c1-18-6-11-24(19(2)16-18)31-26(34)23-17-30-33(22-9-7-21(29)8-10-22)25(23)20-12-14-32(15-13-20)27(35)36-28(3,4)5/h6-11,16-17,20H,12-15H2,1-5H3,(H,31,34)
InChIKey XTHHBYHKXSPJGB-UHFFFAOYSA-N
Molecular Weight 509.050 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_5898
Solvent DMSO-d6
Source Vendor ID: NMR/12709323