SpectraBase Spectrum ID |
BbWkzPiswnG |
Name |
3-(5-cyano-1-ethyl-2-methyl-1H-benzo[d]imidazol-3-ium-3-yl)propane-1-sulfonate |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
307.099062590 u |
Formula |
C14H17N3O3S |
InChI |
InChI=1S/C14H17N3O3S/c1-3-16-11(2)17(7-4-8-21(18,19)20)14-9-12(10-15)5-6-13(14)16/h5-6,9H,3-4,7-8H2,1-2H3 |
InChIKey |
BYSHIRLWRJNDLW-UHFFFAOYSA-N |
Molecular Weight |
307.368 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_18021 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/11270635; Lab Info: ABR; Lab Number: ABR-0000010 |