SpectraBase Spectrum ID |
CBCdSEn4UDB |
Name |
1-piperidinecarboxylic acid, 4-[4-[[(5-chloro-2-methoxyphenyl)amino]carbonyl]-1-(3,4-dimethylphenyl)-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 |
538.234683319 u |
Formula |
C29H35ClN4O4 |
InChI |
InChI=1S/C29H35ClN4O4/c1-18-7-9-22(15-19(18)2)34-26(20-11-13-33(14-12-20)28(36)38-29(3,4)5)23(17-31-34)27(35)32-24-16-21(30)8-10-25(24)37-6/h7-10,15-17,20H,11-14H2,1-6H3,(H,32,35) |
InChIKey |
UGASPRKNPYRMBH-UHFFFAOYSA-N |
Molecular Weight |
539.076 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_5386 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12708209 |