| SpectraBase Spectrum ID |
KON0bdiwLpZ |
| Name |
Diethyl 4'-(3-chlorobenzoyl)-5'-(4-cyanophenyl)-Tetrathiafulvalene-4,5-dicarboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H18ClNO5S4 |
| InChI |
InChI=1S/C26H18ClNO5S4/c1-3-32-23(30)21-22(24(31)33-4-2)37-26(36-21)25-34-19(15-10-8-14(13-28)9-11-15)20(35-25)18(29)16-6-5-7-17(27)12-16/h5-12H,3-4H2,1-2H3 |
| InChIKey |
HOIVLKQJNXQDRY-UHFFFAOYSA-N |
| Literature Reference DOI |
10.1021/acs.orglett.5b02715 |
| Molecular Weight |
588.125 g/mol |
| SMILES |
C1(SC(=C(S1)C(=O)OCC)C(=O)OCC)=C1SC(=C(S1)c1ccc(cc1)C#N)C(c1cc(ccc1)Cl)=O |
| SPLASH |
splash10-000i-1900150000-a441945341a3378495f0 |
| Source of Spectrum |
A1-17-5356/SM40-9h |
| Synonyms |
Diethyl 4'-(3-chlorobenzoyl)-5'-(4-cyanophenyl)-[2,2'-bi(1,3-dithiolylidene)]-4,5-dicarboxylate |
| Wiley ID |
1802611 |
