SpectraBase Spectrum ID |
10vtQly1Jr8 |
Name |
1-piperidinecarboxylic acid, 4-[4-[[(3-chloro-2-methylphenyl)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 |
528.169496239 u |
Formula |
C27H30Cl2N4O3 |
InChI |
InChI=1S/C27H30Cl2N4O3/c1-17-22(29)6-5-7-23(17)31-25(34)21-16-30-33(20-10-8-19(28)9-11-20)24(21)18-12-14-32(15-13-18)26(35)36-27(2,3)4/h5-11,16,18H,12-15H2,1-4H3,(H,31,34) |
InChIKey |
AIWMRQHFFXKEIZ-UHFFFAOYSA-N |
Molecular Weight |
529.468 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_6003 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12709460 |