| SpectraBase Spectrum ID |
FXum3vcc7oV |
| Name |
4-[([1,2,4]triazolo[3,4-b][1,3]benzothiazol-3-ylsulfanyl)methyl]benzonitrile |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
322.034688686 u |
| Formula |
C16H10N4S2 |
| InChI |
InChI=1S/C16H10N4S2/c17-9-11-5-7-12(8-6-11)10-21-15-18-19-16-20(15)13-3-1-2-4-14(13)22-16/h1-8H,10H2 |
| InChIKey |
XXYFMIXOSMBPIG-UHFFFAOYSA-N |
| Molecular Weight |
322.404 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_5651 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/12318895 |
| Temperature |
29.85 °C |
![4-[([1,2,4]triazolo[3,4-b][1,3]benzothiazol-3-ylsulfanyl)methyl]benzonitrile](/api/spectrum/FXum3vcc7oV/structure.png?h=300&w=458 "4-[([1,2,4]triazolo[3,4-b][1,3]benzothiazol-3-ylsulfanyl)methyl]benzonitrile")
