SpectraBase Spectrum ID |
6fzY0Mg9Flk |
Name |
3,5-pyrazolidinedione, 1-(3,4-dimethylphenyl)-4-[[3-(4-fluorophenyl)-1H-pyrazol-4-yl]methylene]-, (4E)- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
376.133553964 u |
Formula |
C21H17FN4O2 |
InChI |
InChI=1S/C21H17FN4O2/c1-12-3-8-17(9-13(12)2)26-21(28)18(20(27)25-26)10-15-11-23-24-19(15)14-4-6-16(22)7-5-14/h3-11H,1-2H3,(H,23,24)(H,25,27)/b18-10+ |
InChIKey |
MMWYIXPQYWHDTM-VCHYOVAHSA-N |
Molecular Weight |
376.391 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_14755 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10320395; Lab Info: SAD; Lab Number: SAD-dast005 |