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piperidinium, 4-[1-(4-chlorophenyl)-4-[[(2,6-dimethylphenyl)amino]carbonyl]-1H-pyrazol-5-yl]-, chloride
SpectraBase Compound ID 9OF2hQNzbgQ
InChI InChI=1S/C23H25ClN4O.ClH/c1-15-4-3-5-16(2)21(15)27-23(29)20-14-26-28(19-8-6-18(24)7-9-19)22(20)17-10-12-25-13-11-17;/h3-9,14,17,25H,10-13H2,1-2H3,(H,27,29);1H
InChIKey JYQFHYHQHABEIY-UHFFFAOYSA-N
Mol Weight 445.39 g/mol
Molecular Formula C23H26Cl2N4O
Exact Mass 444.148367 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1q1Bj2PS000
Name piperidinium, 4-[1-(4-chlorophenyl)-4-[[(2,6-dimethylphenyl)amino]carbonyl]-1H-pyrazol-5-yl]-, chloride
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 444.148366872 u
Formula C23H26Cl2N4O
InChI InChI=1S/C23H25ClN4O.ClH/c1-15-4-3-5-16(2)21(15)27-23(29)20-14-26-28(19-8-6-18(24)7-9-19)22(20)17-10-12-25-13-11-17;/h3-9,14,17,25H,10-13H2,1-2H3,(H,27,29);1H
InChIKey JYQFHYHQHABEIY-UHFFFAOYSA-N
Molecular Weight 445.394 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_6637
Solvent DMSO-d6
Source Vendor ID: NMR/12709827