SpectraBase Spectrum ID |
DdqOSAEzkr1 |
Name |
TTF Meta-6-Acid [4',4,5-Tri(methylthia)-5'-[12-(4-carboxybenzoyl)dodecylthia]tetrathiafulvalene] |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C28H38O3S8 |
InChI |
InChI=1S/C28H38O3S8/c1-32-23-24(33-2)37-27(36-23)28-38-25(34-3)26(39-28)35-18-13-11-9-7-5-4-6-8-10-12-17-31-21-16-14-15-20(19-21)22(29)30/h14-16,19H,4-13,17-18H2,1-3H3,(H,29,30) |
InChIKey |
BFBCBGKVRUNJPR-UHFFFAOYSA-N |
Molecular Weight |
679.089 g/mol |
SMILES |
OC(c1cc(OCCCCCCCCCCCCSC=2SC(=C3SC(SC)=C(S3)SC)SC2SC)ccc1)=O |
SPLASH |
splash10-004i-0200009000-d5d8ce3771aeb2f01670 |
Source of Spectrum |
F-67-9137-21 |
Wiley ID |
1571354 |