SpectraBase Spectrum ID |
52xxAmqDjBf |
Name |
5-[(4-fluorobenzyl)sulfanyl]-8,9-dimethoxy-2-(4-nitrophenyl)[1,2,4]triazolo[1,5-c]quinazoline |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
491.106353413 u |
Formula |
C24H18FN5O4S |
InChI |
InChI=1S/C24H18FN5O4S/c1-33-20-11-18-19(12-21(20)34-2)26-24(35-13-14-3-7-16(25)8-4-14)29-23(18)27-22(28-29)15-5-9-17(10-6-15)30(31)32/h3-12H,13H2,1-2H3 |
InChIKey |
FZRGUBZIYJGUMY-UHFFFAOYSA-N |
Molecular Weight |
491.497 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2020_7056 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12329569 |