| SpectraBase Spectrum ID |
8xGA1NToxg |
| Name |
benzonitrile, 2-[(5H-[1,2,4]triazino[5,6-b]indol-3-ylthio)methyl]- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
317.073516548 u |
| Formula |
C17H11N5S |
| InChI |
InChI=1S/C17H11N5S/c18-9-11-5-1-2-6-12(11)10-23-17-20-16-15(21-22-17)13-7-3-4-8-14(13)19-16/h1-8H,10H2,(H,19,20,22) |
| InChIKey |
ZPDRDPNCESNTKM-UHFFFAOYSA-N |
| Molecular Weight |
317.370 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_1775 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: ZI/8170555; Lab Info: NKS; Lab Number: NKS-000229 |
| Temperature |
29.85 °C |
![benzonitrile, 2-[(5H-[1,2,4]triazino[5,6-b]indol-3-ylthio)methyl]-](/api/spectrum/8xGA1NToxg/structure.png?h=300&w=458 "benzonitrile, 2-[(5H-[1,2,4]triazino[5,6-b]indol-3-ylthio)methyl]-")
