SpectraBase Spectrum ID |
8HeCuD4V4ij |
Name |
2-[(1H-benzimidazol-2-ylsulfanyl)methyl]-1-methyl-1H-indole-3-carbonitrile |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
318.093917641 u |
Formula |
C18H14N4S |
InChI |
InChI=1S/C18H14N4S/c1-22-16-9-5-2-6-12(16)13(10-19)17(22)11-23-18-20-14-7-3-4-8-15(14)21-18/h2-9H,11H2,1H3,(H,20,21) |
InChIKey |
IPXRIRWGFWMYQK-UHFFFAOYSA-N |
Molecular Weight |
318.398 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2020_4988 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12267673; Lab Info: JMR; Lab Number: JMR-0002180 |