| SpectraBase Spectrum ID |
ITU8QTQUtnt |
| Name |
7,10-Dimethoxy-2-thioxo-1,3,5,12-tetrathiatricyclo[8.7.4.2.0(4,13).0(6,11)]trideca-4,6,7,9-tetraene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
331.912785366 u |
| Formula |
C11H8O2S5 |
| InChI |
InChI=1S/C11H8O2S5/c1-12-5-3-4-6(13-2)8-7(5)15-9-10(16-8)18-11(14)17-9/h3-4H,1-2H3 |
| InChIKey |
OFFGYTJMTZARDB-UHFFFAOYSA-N |
| Molecular Weight |
332.483 g/mol |
| SMILES |
C12=C(SC(S2)=S)SC=2C(S1)=C(C=CC2OC)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.902819 |
![7,10-Dimethoxy-2-thioxo-1,3,5,12-tetrathiatricyclo[8.7.4.2.0(4,13).0(6,11)]trideca-4,6,7,9-tetraene](/api/spectrum/ITU8QTQUtnt/structure.png?h=300&w=458 "7,10-Dimethoxy-2-thioxo-1,3,5,12-tetrathiatricyclo[8.7.4.2.0(4,13).0(6,11)]trideca-4,6,7,9-tetraene")
