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piperidinium, 4-[1-(4-chlorophenyl)-4-[[[(4-methylphenyl)methyl]amino]carbonyl]-1H-pyrazol-5-yl]-, chloride
SpectraBase Compound ID 4pqJmyx3rKg
InChI InChI=1S/C23H25ClN4O.ClH/c1-16-2-4-17(5-3-16)14-26-23(29)21-15-27-28(20-8-6-19(24)7-9-20)22(21)18-10-12-25-13-11-18;/h2-9,15,18,25H,10-14H2,1H3,(H,26,29);1H
InChIKey AYDXRJJUAQQASB-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 68rmJy4oVUM
Name piperidinium, 4-[1-(4-chlorophenyl)-4-[[[(4-methylphenyl)methyl]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/c1-16-2-4-17(5-3-16)14-26-23(29)21-15-27-28(20-8-6-19(24)7-9-20)22(21)18-10-12-25-13-11-18;/h2-9,15,18,25H,10-14H2,1H3,(H,26,29);1H
InChIKey AYDXRJJUAQQASB-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_6665
Solvent DMSO-d6
Source Vendor ID: NMR/12709906