| SpectraBase Spectrum ID |
CmNnsxIaOIH |
| Name |
TTF para-2-Acid [4,5-Bis(hexylthia)-4'-methylthia-5'-(4-carboxybenzylthia)tetrathiafulvalene] |
| Alternate Name(s) |
4-[[2-[4,5-bis(hexylsulfanyl)-1,3-dithiol-2-ylidene]-5-methylsulfanyl-1,3-dithiol-4-yl]sulfanylmethyl]benzoic acid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H36O2S8 |
| InChI |
InChI=1S/C27H36O2S8/c1-4-6-8-10-16-31-24-25(32-17-11-9-7-5-2)37-27(36-24)26-34-22(30-3)23(35-26)33-18-19-12-14-20(15-13-19)21(28)29/h12-15H,4-11,16-18H2,1-3H3,(H,28,29) |
| InChIKey |
ZHGIIUHSEJLSQP-UHFFFAOYSA-N |
| Molecular Weight |
649.063 g/mol |
| SMILES |
OC(c1ccc(CSC=2SC(=C3SC(SCCCCCC)=C(S3)SCCCCCC)SC2SC)cc1)=O |
| SPLASH |
splash10-01ot-0100039000-3ff5012c2e4ce477b9c3 |
| Source of Spectrum |
F-67-9136-5 |
| Wiley ID |
1571366 |
![TTF para-2-Acid [4,5-Bis(hexylthia)-4'-methylthia-5'-(4-carboxybenzylthia)tetrathiafulvalene]](/api/spectrum/CmNnsxIaOIH/structure.png?h=300&w=458 "TTF para-2-Acid [4,5-Bis(hexylthia)-4'-methylthia-5'-(4-carboxybenzylthia)tetrathiafulvalene]")
