SpectraBase Spectrum ID |
fmOog68j1l |
Name |
1-piperidinecarboxylic acid, 4-[1-(3-chloro-4-methylphenyl)-4-[[(3-chloro-4-methylphenyl)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 |
542.185146303 u |
Formula |
C28H32Cl2N4O3 |
InChI |
InChI=1S/C28H32Cl2N4O3/c1-17-6-8-20(14-23(17)29)32-26(35)22-16-31-34(21-9-7-18(2)24(30)15-21)25(22)19-10-12-33(13-11-19)27(36)37-28(3,4)5/h6-9,14-16,19H,10-13H2,1-5H3,(H,32,35) |
InChIKey |
BELZKDHAXCXXBC-UHFFFAOYSA-N |
Molecular Weight |
543.495 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_6707 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12709997 |