SpectraBase Spectrum ID |
6FPuw1EJASI |
Name |
1-piperidinecarboxylic acid, 4-[1-(3-chloro-4-methylphenyl)-4-[[(3-methoxyphenyl)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 |
524.219033255 u |
Formula |
C28H33ClN4O4 |
InChI |
InChI=1S/C28H33ClN4O4/c1-18-9-10-21(16-24(18)29)33-25(19-11-13-32(14-12-19)27(35)37-28(2,3)4)23(17-30-33)26(34)31-20-7-6-8-22(15-20)36-5/h6-10,15-17,19H,11-14H2,1-5H3,(H,31,34) |
InChIKey |
DFNRFJDXRQWULC-UHFFFAOYSA-N |
Molecular Weight |
525.049 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_6756 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12718085 |