| SpectraBase Spectrum ID |
2wAV5Rtu1nR |
| Name |
4,5-Bis(p-Acetyloxybenzylsulfanyl)-4',5'-bis(hexylsulfanyl)tetrathiafulvalene |
| Alternate Name(s) |
4-({[5-({[4-(acetyloxy)phenyl]methyl}sulfanyl)-2-[4,5-bis(hexylsulfanyl)-2H-1,3-dithiol-2-ylidene]-2H-1,3-dithiol-4-yl]sulfanyl}methyl)phenyl acetate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C36H44O4S8 |
| InChI |
InChI=1S/C36H44O4S8/c1-5-7-9-11-21-41-31-32(42-22-12-10-8-6-2)46-35(45-31)36-47-33(43-23-27-13-17-29(18-14-27)39-25(3)37)34(48-36)44-24-28-15-19-30(20-16-28)40-26(4)38/h13-20H,5-12,21-24H2,1-4H3 |
| InChIKey |
XPJLOQBFDSLPRB-UHFFFAOYSA-N |
| Molecular Weight |
797.224 g/mol |
| SMILES |
C1(=C2SC(SCCCCCC)=C(S2)SCCCCCC)SC(SCc2ccc(OC(=O)C)cc2)=C(S1)SCc1ccc(OC(=O)C)cc1 |
| SPLASH |
splash10-0002-0000402900-8c4c6b1b64c9bd19b452 |
| Source of Spectrum |
F-54-2861-12 |
| Wiley ID |
806363 |
