SpectraBase Spectrum ID |
8wn8B9FLU4F |
Name |
1-piperazinecarbothioamide, N-(2-chloro-4-methylphenyl)-4-[3-(4-fluorophenyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
481.125170741 u |
Formula |
C23H21ClFN7S |
InChI |
InChI=1S/C23H21ClFN7S/c1-15-2-7-19(18(24)14-15)26-23(33)31-12-10-30(11-13-31)21-9-8-20-27-28-22(32(20)29-21)16-3-5-17(25)6-4-16/h2-9,14H,10-13H2,1H3,(H,26,33) |
InChIKey |
NGSHICPVQRHCBN-UHFFFAOYSA-N |
Molecular Weight |
481.981 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_2915 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12689581 |