| SpectraBase Spectrum ID |
9wa3n2rjElJ |
| Name |
TTF Para-6-Acid [4',4,5-Tri(methylthia)-5'-[4-(4-carboxybenzoyl)butylthia]tetrathiafulvalene] |
| Alternate Name(s) |
4-[4-[[2-[4,5-bis(methylsulfanyl)-1,3-dithiol-2-ylidene]-5-methylsulfanyl-1,3-dithiol-4-yl]sulfanyl]butoxy]benzoic acid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H22O3S8 |
| InChI |
InChI=1S/C20H22O3S8/c1-24-15-16(25-2)29-19(28-15)20-30-17(26-3)18(31-20)27-11-5-4-10-23-13-8-6-12(7-9-13)14(21)22/h6-9H,4-5,10-11H2,1-3H3,(H,21,22) |
| InChIKey |
YOTOEHKVTZQLQZ-UHFFFAOYSA-N |
| Molecular Weight |
566.873 g/mol |
| SMILES |
OC(c1ccc(OCCCCSC=2SC(=C3SC(SC)=C(S3)SC)SC2SC)cc1)=O |
| SPLASH |
splash10-014i-1211090000-25731724c9ad9d0d7bab |
| Source of Spectrum |
F-67-9136-9 |
| Wiley ID |
1571363 |
![TTF Para-6-Acid [4',4,5-Tri(methylthia)-5'-[4-(4-carboxybenzoyl)butylthia]tetrathiafulvalene]](/api/spectrum/9wa3n2rjElJ/structure.png?h=300&w=458 "TTF Para-6-Acid [4',4,5-Tri(methylthia)-5'-[4-(4-carboxybenzoyl)butylthia]tetrathiafulvalene]")
