SpectraBase Spectrum ID |
6VmFB93KnO |
Name |
3-penten-2-one, 3-[[3-(4-fluorophenyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]thio]-4-hydroxy-, (3E)- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
344.074325010 u |
Formula |
C16H13FN4O2S |
InChI |
InChI=1S/C16H13FN4O2S/c1-9(22)15(10(2)23)24-14-8-7-13-18-19-16(21(13)20-14)11-3-5-12(17)6-4-11/h3-8,22H,1-2H3/b15-9+ |
InChIKey |
YYDYPEKRAQALRR-OQLLNIDSSA-N |
Molecular Weight |
344.364 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_8497 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/13309444 |