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piperidinium, 4-[1-(3,4-dimethylphenyl)-4-[[[3-(trifluoromethyl)phenyl]amino]carbonyl]-1H-pyrazol-5-yl]-, chloride
SpectraBase Compound ID K7yukcVUwn4
InChI InChI=1S/C24H25F3N4O.ClH/c1-15-6-7-20(12-16(15)2)31-22(17-8-10-28-11-9-17)21(14-29-31)23(32)30-19-5-3-4-18(13-19)24(25,26)27;/h3-7,12-14,17,28H,8-11H2,1-2H3,(H,30,32);1H
InChIKey JAERONMGWYOWOO-UHFFFAOYSA-N
Mol Weight 478.95 g/mol
Molecular Formula C24H26ClF3N4O
Exact Mass 478.174724 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7MrHCZDFzEX
Name piperidinium, 4-[1-(3,4-dimethylphenyl)-4-[[[3-(trifluoromethyl)phenyl]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 478.174723661 u
Formula C24H26ClF3N4O
InChI InChI=1S/C24H25F3N4O.ClH/c1-15-6-7-20(12-16(15)2)31-22(17-8-10-28-11-9-17)21(14-29-31)23(32)30-19-5-3-4-18(13-19)24(25,26)27;/h3-7,12-14,17,28H,8-11H2,1-2H3,(H,30,32);1H
InChIKey JAERONMGWYOWOO-UHFFFAOYSA-N
Molecular Weight 478.947 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_5409
Solvent DMSO-d6
Source Vendor ID: NMR/12708357