SpectraBase Spectrum ID |
JuMOyzpJK7z |
Name |
2-propenoic acid, 2-cyano-3-[1-[(2,6-dichlorophenyl)methyl]-3-phenyl-1H-pyrazol-4-yl]-, ethyl ester, (2Z)- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
425.069782197 u |
Formula |
C22H17Cl2N3O2 |
InChI |
InChI=1S/C22H17Cl2N3O2/c1-2-29-22(28)16(12-25)11-17-13-27(14-18-19(23)9-6-10-20(18)24)26-21(17)15-7-4-3-5-8-15/h3-11,13H,2,14H2,1H3/b16-11- |
InChIKey |
KNBOUWPUJBELSM-WJDWOHSUSA-N |
Molecular Weight |
426.303 g/mol |
NMR Offset |
16.0471 |
NMR Spectrometer Frequency |
200.133 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_939 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/8306768; Lab Info: PNA; Lab Number: PNA-0006789 |
Temperature |
23.85 °C |