SpectraBase Spectrum ID |
LmRp5lzJfpf |
Name |
1-piperidinecarboxylic acid, 4-[1-(4-chlorophenyl)-4-[[(2,3-dichlorophenyl)amino]carbonyl]-1H-pyrazol-5-yl]-, 1,1-dimethylethyl ester |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
548.114873842 u |
Formula |
C26H27Cl3N4O3 |
InChI |
InChI=1S/C26H27Cl3N4O3/c1-26(2,3)36-25(35)32-13-11-16(12-14-32)23-19(15-30-33(23)18-9-7-17(27)8-10-18)24(34)31-21-6-4-5-20(28)22(21)29/h4-10,15-16H,11-14H2,1-3H3,(H,31,34) |
InChIKey |
XJZZPGTVEOCOTI-UHFFFAOYSA-N |
Molecular Weight |
549.886 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_6113 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12709634 |