SpectraBase Spectrum ID |
3OKLCyLX6V2 |
Name |
1-piperazinecarbothioamide, 4-[3-(4-fluorophenyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-N-(1-methylethyl)- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
399.164143073 u |
Formula |
C19H22FN7S |
InChI |
InChI=1S/C19H22FN7S/c1-13(2)21-19(28)26-11-9-25(10-12-26)17-8-7-16-22-23-18(27(16)24-17)14-3-5-15(20)6-4-14/h3-8,13H,9-12H2,1-2H3,(H,21,28) |
InChIKey |
JPGOQBBFVMNNMQ-UHFFFAOYSA-N |
Molecular Weight |
399.492 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_2919 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12689585 |