SpectraBase Spectrum ID |
EvuomO7pCz5 |
Name |
1-piperidinecarboxylic acid, 4-[4-[[(3-chloro-4-methoxyphenyl)amino]carbonyl]-1-(4-chlorophenyl)-1H-pyrazol-5-yl]-, 1,1- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
544.164410858 u |
Formula |
C27H30Cl2N4O4 |
InChI |
InChI=1S/C27H30Cl2N4O4/c1-27(2,3)37-26(35)32-13-11-17(12-14-32)24-21(16-30-33(24)20-8-5-18(28)6-9-20)25(34)31-19-7-10-23(36-4)22(29)15-19/h5-10,15-17H,11-14H2,1-4H3,(H,31,34) |
InChIKey |
LJJIDSJKIRIMOJ-UHFFFAOYSA-N |
Molecular Weight |
545.467 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_6635 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12709825 |