| SpectraBase Spectrum ID |
7X08Qq4nqH2 |
| Name |
4-(5-Chloro-Tetrathiafulvalene-4-yl)benzonitrile |
| Alternate Name(s) |
4-(5-Chloro-[2,2'-bi(1,3-dithiolylidene)]-4-yl)benzonitrile |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H6ClNS4 |
| InChI |
InChI=1S/C13H6ClNS4/c14-11-10(9-3-1-8(7-15)2-4-9)18-13(19-11)12-16-5-6-17-12/h1-6H |
| InChIKey |
KPGIWBUYIAKZBB-UHFFFAOYSA-N |
| Literature Reference DOI |
10.1021/acs.orglett.5b02715 |
| Molecular Weight |
339.891 g/mol |
| SMILES |
C1(=C2SC=CS2)SC(c2ccc(cc2)C#N)=C(Cl)S1 |
| SPLASH |
splash10-000f-0449000000-245a9acead32e02de2fd |
| Source of Spectrum |
A1-17-5356/SM23-7d |
| Wiley ID |
1802597 |
