SpectraBase Spectrum ID |
Eg5DxSEx2MV |
Name |
1-piperidinecarboxylic acid, 4-[1-(3-chloro-4-methylphenyl)-4-[[(2,4,6-trimethylphenyl)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/c1-18-14-20(3)26(21(4)15-18)33-28(36)24-17-32-35(23-9-8-19(2)25(31)16-23)27(24)22-10-12-34(13-11-22)29(37)38-30(5,6)7/h8-9,14-17,22H,10-13H2,1-7H3,(H,33,36) |
InChIKey |
IKAVBNPCGGOXBJ-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_6686 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12709962 |