| SpectraBase Spectrum ID |
FXeWZBL7Eam |
| Name |
1,1':3,3'-Bis(tri(ethyleneglycol))bis(benzimidazolium) Ditosylate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C40H48N4O10S2 |
| InChI |
InChI=1S/C26H34N4O4.2C7H8O3S/c1-2-6-24-23(5-1)27-9-13-31-17-18-33-15-11-29-22-30(26-8-4-3-7-25(26)29)12-16-34-20-19-32-14-10-28(24)21-27;2*1-6-2-4-7(5-3-6)11(8,9)10/h1-8,21-22H,9-20H2;2*2-5H,1H3,(H,8,9,10)/q+2;;/p-2 |
| InChIKey |
ZPIDETSTCJLKIS-UHFFFAOYSA-L |
| Molecular Weight |
808.962 g/mol |
| SMILES |
c1(S([O-])(=O)=O)ccc(cc1)C.c1[n+]2CCOCCOCC[n+]3c[n](CCOCCOCC[n]1c1c2cccc1)c1c3cccc1.c1(S([O-])(=O)=O)ccc(C)cc1 |
| SPLASH |
splash10-0a4r-0900006000-f70a02160cab998736c3 |
| Source of Spectrum |
F-70-5812-8 |
| Wiley ID |
1597183 |
