SpectraBase Spectrum ID |
2UHgGY0rJ9E |
Name |
1-piperidinecarboxylic acid, 4-[1-(3-chloro-4-methylphenyl)-4-[[(2-ethyl-6-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 |
536.255418764 u |
Formula |
C30H37ClN4O3 |
InChI |
InChI=1S/C30H37ClN4O3/c1-7-21-10-8-9-20(3)26(21)33-28(36)24-18-32-35(23-12-11-19(2)25(31)17-23)27(24)22-13-15-34(16-14-22)29(37)38-30(4,5)6/h8-12,17-18,22H,7,13-16H2,1-6H3,(H,33,36) |
InChIKey |
PKRJSEQDGAJWOM-UHFFFAOYSA-N |
Molecular Weight |
537.104 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_6703 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12709993 |