| SpectraBase Spectrum ID |
2gVe7xgWwRy |
| Name |
acetamide, 2-[[7-(2-ethylhexyl)-2,3,6,7-tetrahydro-1,3-dimethyl-2,6-dioxo-1H-purin-8-yl]thio]-N-[4-(trifluoromethoxy)phenyl]- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
541.197060125 u |
| Formula |
C24H30F3N5O4S |
| InChI |
InChI=1S/C24H30F3N5O4S/c1-5-7-8-15(6-2)13-32-19-20(30(3)23(35)31(4)21(19)34)29-22(32)37-14-18(33)28-16-9-11-17(12-10-16)36-24(25,26)27/h9-12,15H,5-8,13-14H2,1-4H3,(H,28,33) |
| InChIKey |
ILXDSXKFVWMDID-UHFFFAOYSA-N |
| Molecular Weight |
541.590 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_17903 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10320396; Lab Info: SAD; Lab Number: SAD-dast006 |
![acetamide, 2-[[7-(2-ethylhexyl)-2,3,6,7-tetrahydro-1,3-dimethyl-2,6-dioxo-1H-purin-8-yl]thio]-N-[4-(trifluoromethoxy)phenyl]-](/api/spectrum/2gVe7xgWwRy/structure.png?h=300&w=458 "acetamide, 2-[[7-(2-ethylhexyl)-2,3,6,7-tetrahydro-1,3-dimethyl-2,6-dioxo-1H-purin-8-yl]thio]-N-[4-(trifluoromethoxy)phenyl]-")
