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piperidinium, 4-[1-(4-chlorophenyl)-4-[[(3-methoxyphenyl)amino]carbonyl]-1H-pyrazol-5-yl]-, chloride
SpectraBase Compound ID 8Z6dO2HmF84
InChI InChI=1S/C22H23ClN4O2.ClH/c1-29-19-4-2-3-17(13-19)26-22(28)20-14-25-27(18-7-5-16(23)6-8-18)21(20)15-9-11-24-12-10-15;/h2-8,13-15,24H,9-12H2,1H3,(H,26,28);1H
InChIKey BNAKZLUGMLOOQR-UHFFFAOYSA-N
Mol Weight 447.37 g/mol
Molecular Formula C22H24Cl2N4O2
Exact Mass 446.127631 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9JlEQZWApfq
Name piperidinium, 4-[1-(4-chlorophenyl)-4-[[(3-methoxyphenyl)amino]carbonyl]-1H-pyrazol-5-yl]-, chloride
Copyright Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 446.127631427 u
Formula C22H24Cl2N4O2
InChI InChI=1S/C22H23ClN4O2.ClH/c1-29-19-4-2-3-17(13-19)26-22(28)20-14-25-27(18-7-5-16(23)6-8-18)21(20)15-9-11-24-12-10-15;/h2-8,13-15,24H,9-12H2,1H3,(H,26,28);1H
InChIKey BNAKZLUGMLOOQR-UHFFFAOYSA-N
Molecular Weight 447.366 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_5925
Solvent DMSO-d6
Source Vendor ID: NMR/12709354