| SpectraBase Spectrum ID |
IgxbSdpA0Gj |
| Name |
(E,E')-3,3'-Trimethylene-bis[2'-(4"-cyanostyryl)benzothiazol-3'-ium]-dibromide |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C35H26Br2N4S2 |
| InChI |
InChI=1S/C35H26N4S2.Br2/c36-24-28-14-10-26(11-15-28)18-20-34-38(30-6-1-3-8-32(30)40-34)22-5-23-39-31-7-2-4-9-33(31)41-35(39)21-19-27-12-16-29(25-37)17-13-27;1-2/h1-4,6-21H,5,22-23H2;/q+2;-2/b20-18+,21-19+; |
| InChIKey |
AYULGRAOBARUKK-RRCQUFFISA-N |
| Molecular Weight |
726.549 g/mol |
| SMILES |
[Br-][Br-].c1([n+](c2c(s1)cccc2)CCC[n+]1c(sc2c1cccc2)\C=C\c1ccc(C#N)cc1)\C=C\c1ccc(C#N)cc1 |
| SPLASH |
splash10-001i-0090000000-f2db31d14fb12b1d4c12 |
| Source of Spectrum |
AH-139-572-4 |
| Wiley ID |
1695677 |
![(E,E')-3,3'-Trimethylene-bis[2'-(4"-cyanostyryl)benzothiazol-3'-ium]-dibromide](/api/spectrum/IgxbSdpA0Gj/structure.png?h=300&w=458 "(E,E')-3,3'-Trimethylene-bis[2'-(4\"-cyanostyryl)benzothiazol-3'-ium]-dibromide")
