SpectraBase Spectrum ID |
8E1ozr2o4r6 |
Name |
1-piperidinecarboxylic acid, 4-[1-(2-chlorophenyl)-4-[[(4-chlorophenyl)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 |
514.153846175 u |
Formula |
C26H28Cl2N4O3 |
InChI |
InChI=1S/C26H28Cl2N4O3/c1-26(2,3)35-25(34)31-14-12-17(13-15-31)23-20(24(33)30-19-10-8-18(27)9-11-19)16-29-32(23)22-7-5-4-6-21(22)28/h4-11,16-17H,12-15H2,1-3H3,(H,30,33) |
InChIKey |
TVQRFZVELAYQSE-UHFFFAOYSA-N |
Molecular Weight |
515.441 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_5998 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12709453 |