SpectraBase Spectrum ID |
3U1CxWd5JN1 |
Name |
piperidinium, 4-[4-[[(3-chloro-2-methylphenyl)amino]carbonyl]-1-(3,4-dimethylphenyl)-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 |
458.164016937 u |
Formula |
C24H28Cl2N4O |
InChI |
InChI=1S/C24H27ClN4O.ClH/c1-15-7-8-19(13-16(15)2)29-23(18-9-11-26-12-10-18)20(14-27-29)24(30)28-22-6-4-5-21(25)17(22)3;/h4-8,13-14,18,26H,9-12H2,1-3H3,(H,28,30);1H |
InChIKey |
INRBXDXSXRMRDJ-UHFFFAOYSA-N |
Molecular Weight |
459.421 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_5403 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12708350 |