SpectraBase Spectrum ID |
Enj3Cixpf13 |
Name |
3,5-pyrazolidinedione, 1-(3-chlorophenyl)-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 |
382.063281503 u |
Formula |
C19H12ClFN4O2 |
InChI |
InChI=1S/C19H12ClFN4O2/c20-13-2-1-3-15(9-13)25-19(27)16(18(26)24-25)8-12-10-22-23-17(12)11-4-6-14(21)7-5-11/h1-10H,(H,22,23)(H,24,26)/b16-8+ |
InChIKey |
CKUMVNNPSPCFPH-LZYBPNLTSA-N |
Molecular Weight |
382.782 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_16175 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/11210070; Lab Info: SAD; Lab Number: 85 |