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piperidinium, 4-[4-[[(4-bromophenyl)amino]carbonyl]-1-(3,4-dimethylphenyl)-1H-pyrazol-5-yl]-, chloride
SpectraBase Compound ID KXl5LHq3RIy
InChI InChI=1S/C23H25BrN4O.ClH/c1-15-3-8-20(13-16(15)2)28-22(17-9-11-25-12-10-17)21(14-26-28)23(29)27-19-6-4-18(24)5-7-19;/h3-8,13-14,17,25H,9-12H2,1-2H3,(H,27,29);1H
InChIKey POTYZERBKJVEGL-UHFFFAOYSA-N
Mol Weight 489.85 g/mol
Molecular Formula C23H26BrClN4O
Exact Mass 488.097852 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KPTZJGIqbJr
Name piperidinium, 4-[4-[[(4-bromophenyl)amino]carbonyl]-1-(3,4-dimethylphenyl)-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 488.097852172 u
Formula C23H26BrClN4O
InChI InChI=1S/C23H25BrN4O.ClH/c1-15-3-8-20(13-16(15)2)28-22(17-9-11-25-12-10-17)21(14-26-28)23(29)27-19-6-4-18(24)5-7-19;/h3-8,13-14,17,25H,9-12H2,1-2H3,(H,27,29);1H
InChIKey POTYZERBKJVEGL-UHFFFAOYSA-N
Molecular Weight 489.845 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_5276
Solvent DMSO-d6
Source Vendor ID: NMR/12708312
Temperature 23.85 °C