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piperidinium, 4-[1-(3,4-dimethylphenyl)-4-[[(4-ethoxyphenyl)amino]carbonyl]-1H-pyrazol-5-yl]-, chloride
SpectraBase Compound ID 3pgRwi7cFaU
InChI InChI=1S/C25H30N4O2.ClH/c1-4-31-22-9-6-20(7-10-22)28-25(30)23-16-27-29(21-8-5-17(2)18(3)15-21)24(23)19-11-13-26-14-12-19;/h5-10,15-16,19,26H,4,11-14H2,1-3H3,(H,28,30);1H
InChIKey PNYHUEPYSLPZAN-UHFFFAOYSA-N
Mol Weight 455.0 g/mol
Molecular Formula C25H31ClN4O2
Exact Mass 454.213554 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID J8ceuSZQMtq
Name piperidinium, 4-[1-(3,4-dimethylphenyl)-4-[[(4-ethoxyphenyl)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 454.213553952 u
Formula C25H31ClN4O2
InChI InChI=1S/C25H30N4O2.ClH/c1-4-31-22-9-6-20(7-10-22)28-25(30)23-16-27-29(21-8-5-17(2)18(3)15-21)24(23)19-11-13-26-14-12-19;/h5-10,15-16,19,26H,4,11-14H2,1-3H3,(H,28,30);1H
InChIKey PNYHUEPYSLPZAN-UHFFFAOYSA-N
Molecular Weight 455.002 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_5383
Solvent DMSO-d6
Source Vendor ID: NMR/12708204