SpectraBase Spectrum ID |
BBq2qw5aRV |
Name |
piperidinium, 4-[1-(2-chlorophenyl)-4-[[(3,5-dichlorophenyl)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 |
484.039122079 u |
Formula |
C21H20Cl4N4O |
InChI |
InChI=1S/C21H19Cl3N4O.ClH/c22-14-9-15(23)11-16(10-14)27-21(29)17-12-26-28(19-4-2-1-3-18(19)24)20(17)13-5-7-25-8-6-13;/h1-4,9-13,25H,5-8H2,(H,27,29);1H |
InChIKey |
JNIQWWHRJTWVSB-UHFFFAOYSA-N |
Molecular Weight |
486.230 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_6641 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12709831 |