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1-piperidinecarboxylic acid, 4-[1-(3-chloro-4-methylphenyl)-4-[[(3,5-dichlorophenyl)amino]carbonyl]-1H-pyrazol-5-yl]-, 1,1-dimethylethyl ester
SpectraBase Compound ID F9PJJoUEV2v
InChI InChI=1S/C27H29Cl3N4O3/c1-16-5-6-21(14-23(16)30)34-24(17-7-9-33(10-8-17)26(36)37-27(2,3)4)22(15-31-34)25(35)32-20-12-18(28)11-19(29)13-20/h5-6,11-15,17H,7-10H2,1-4H3,(H,32,35)
InChIKey ZIJYVPBLFULVON-UHFFFAOYSA-N
Mol Weight 563.91 g/mol
Molecular Formula C27H29Cl3N4O3
Exact Mass 562.130524 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9RQOqFp4Gbe
Name 1-piperidinecarboxylic acid, 4-[1-(3-chloro-4-methylphenyl)-4-[[(3,5-dichlorophenyl)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 562.130523907 u
Formula C27H29Cl3N4O3
InChI InChI=1S/C27H29Cl3N4O3/c1-16-5-6-21(14-23(16)30)34-24(17-7-9-33(10-8-17)26(36)37-27(2,3)4)22(15-31-34)25(35)32-20-12-18(28)11-19(29)13-20/h5-6,11-15,17H,7-10H2,1-4H3,(H,32,35)
InChIKey ZIJYVPBLFULVON-UHFFFAOYSA-N
Molecular Weight 563.913 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_6762
Solvent DMSO-d6
Source Vendor ID: NMR/12718093