SpectraBase Spectrum ID |
HAeIYT3U0Jp |
Name |
piperidinium, 4-[4-[[(4-chlorophenyl)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 |
444.148366872 u |
Formula |
C23H26Cl2N4O |
InChI |
InChI=1S/C23H25ClN4O.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 |
PQHZXTJHLQKISL-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_6021 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12709481 |