| SpectraBase Spectrum ID |
DfXbAdOafxf |
| Name |
acetamide, 2-[[5-(1-methylethyl)-5H-[1,2,4]triazino[5,6-b]indol-3-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 |
461.113330501 u |
| Formula |
C21H18F3N5O2S |
| InChI |
InChI=1S/C21H18F3N5O2S/c1-12(2)29-16-6-4-3-5-15(16)18-19(29)26-20(28-27-18)32-11-17(30)25-13-7-9-14(10-8-13)31-21(22,23)24/h3-10,12H,11H2,1-2H3,(H,25,30) |
| InChIKey |
LNJSDXHOMMETGG-UHFFFAOYSA-N |
| Molecular Weight |
461.463 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_2056 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/9226019; Lab Info: L-23,Kulik; Lab Number: BLOK-0000020 |
![acetamide, 2-[[5-(1-methylethyl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]thio]-N-[4-(trifluoromethoxy)phenyl]-](/api/spectrum/DfXbAdOafxf/structure.png?h=300&w=458 "acetamide, 2-[[5-(1-methylethyl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]thio]-N-[4-(trifluoromethoxy)phenyl]-")
