| SpectraBase Spectrum ID |
5NmB1C8AU6m |
| Name |
(E,E')-3,3'-Pentamethylene-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 |
C37H30Br2N4S2 |
| InChI |
InChI=1S/C37H30N4S2.Br2/c38-26-30-16-12-28(13-17-30)20-22-36-40(32-8-2-4-10-34(32)42-36)24-6-1-7-25-41-33-9-3-5-11-35(33)43-37(41)23-21-29-14-18-31(27-39)19-15-29;1-2/h2-5,8-23H,1,6-7,24-25H2;/q+2;-2/b22-20+,23-21+; |
| InChIKey |
LHOCOZYNBVXIDF-AFLLVNNISA-N |
| Molecular Weight |
754.603 g/mol |
| SMILES |
[Br-][Br-].c1([n+](c2c(s1)cccc2)CCCCC[n+]1c(sc2c1cccc2)\C=C\c1ccc(C#N)cc1)\C=C\c1ccc(C#N)cc1 |
| SPLASH |
splash10-0002-0090000000-e883f04f2c97c29c2ddb |
| Source of Spectrum |
AH-139-572-5 |
| Wiley ID |
1695676 |
![(E,E')-3,3'-Pentamethylene-bis[2'-(4"-cyanostyryl)benzothiazol-3'-ium]-dibromide](/api/spectrum/5NmB1C8AU6m/structure.png?h=300&w=458 "(E,E')-3,3'-Pentamethylene-bis[2'-(4\"-cyanostyryl)benzothiazol-3'-ium]-dibromide")
