| SpectraBase Spectrum ID |
6x1tEHb2rE5 |
| Name |
4',5'-bis(hydroxymethyl)-4,5-bis(methoxycarbonyl)tetrathiafulvalene |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H12O6S4 |
| InChI |
InChI=1S/C12H12O6S4/c1-17-9(15)7-8(10(16)18-2)22-12(21-7)11-19-5(3-13)6(4-14)20-11/h13-14H,3-4H2,1-2H3 |
| InChIKey |
DXOAHVHBWDHBKA-UHFFFAOYSA-N |
| Molecular Weight |
380.462 g/mol |
| SMILES |
OCC=1SC(SC1CO)=C1SC(=C(S1)C(=O)OC)C(=O)OC |
| SPLASH |
splash10-001i-0009000000-f08822e7d56b4e218f2d |
| Source of Spectrum |
AT-39-8666-4 |
| Synonyms |
4,5-dimethyl 2-[4,5-bis(hydroxymethyl)-2H-1,3-dithiol-2-ylidene]-2H-1,3-dithiole-4,5-dicarboxylate |
| Wiley ID |
854373 |
