SpectraBase Spectrum ID |
CD6mHCDv54F |
Name |
ethanone, 1-(4-fluorophenyl)-2-[[4-phenyl-5-(phenylamino)-4H-1,2,4-triazol-3-yl]thio]- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
404.110710519 u |
Formula |
C22H17FN4OS |
InChI |
InChI=1S/C22H17FN4OS/c23-17-13-11-16(12-14-17)20(28)15-29-22-26-25-21(24-18-7-3-1-4-8-18)27(22)19-9-5-2-6-10-19/h1-14H,15H2,(H,24,25) |
InChIKey |
YDHOWUWBODKCPW-UHFFFAOYSA-N |
Molecular Weight |
404.463 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_17296 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10311328; Lab Info: LP; Lab Number: LP-2101622 |