SpectraBase Spectrum ID |
1GX00RM9tHv |
Name |
piperidinium, 4-[4-[[(5-chloro-2-methylphenyl)amino]carbonyl]-1-(2-chlorophenyl)-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 |
464.093744476 u |
Formula |
C22H23Cl3N4O |
InChI |
InChI=1S/C22H22Cl2N4O.ClH/c1-14-6-7-16(23)12-19(14)27-22(29)17-13-26-28(20-5-3-2-4-18(20)24)21(17)15-8-10-25-11-9-15;/h2-7,12-13,15,25H,8-11H2,1H3,(H,27,29);1H |
InChIKey |
GHALYWXHHMSQEZ-UHFFFAOYSA-N |
Molecular Weight |
465.812 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_6661 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12709898 |