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

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1-piperidinecarboxylic acid, 4-[4-[[(4-bromophenyl)amino]carbonyl]-1-(4-chlorophenyl)-1H-pyrazol-5-yl]-, 1,1-dimethylethyl ester
SpectraBase Compound ID F8FNUYjeqtW
InChI InChI=1S/C26H28BrClN4O3/c1-26(2,3)35-25(34)31-14-12-17(13-15-31)23-22(24(33)30-20-8-4-18(27)5-9-20)16-29-32(23)21-10-6-19(28)7-11-21/h4-11,16-17H,12-15H2,1-3H3,(H,30,33)
InChIKey LZHNMQHFVGMVDT-UHFFFAOYSA-N
Mol Weight 559.89 g/mol
Molecular Formula C26H28BrClN4O3
Exact Mass 558.103331 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID I4BJ0BqGGxS
Name 1-piperidinecarboxylic acid, 4-[4-[[(4-bromophenyl)amino]carbonyl]-1-(4-chlorophenyl)-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 558.103331475 u
Formula C26H28BrClN4O3
InChI InChI=1S/C26H28BrClN4O3/c1-26(2,3)35-25(34)31-14-12-17(13-15-31)23-22(24(33)30-20-8-4-18(27)5-9-20)16-29-32(23)21-10-6-19(28)7-11-21/h4-11,16-17H,12-15H2,1-3H3,(H,30,33)
InChIKey LZHNMQHFVGMVDT-UHFFFAOYSA-N
Molecular Weight 559.892 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_5914
Solvent DMSO-d6
Source Vendor ID: NMR/12709341