![4-Methyl-6-phenyl-1,3-dihydro-1H-2.lamada.6-thieno[3,4-c]thiophene-2,2-dione](/api/spectrum/4LtEtmlBGNa/structure.png?h=300&w=458 "4-Methyl-6-phenyl-1,3-dihydro-1H-2.lamada.6-thieno[3,4-c]thiophene-2,2-dione")
| SpectraBase Compound ID | BOP4b331o0g |
|---|---|
| InChI | InChI=1S/C13H12O2S2/c1-9-11-7-17(14,15)8-12(11)13(16-9)10-5-3-2-4-6-10/h2-6H,7-8H2,1H3 |
| InChIKey | QXDWKZKXYJMMTF-UHFFFAOYSA-N |
| Mol Weight | 264.36 g/mol |
| Molecular Formula | C13H12O2S2 |
| Exact Mass | 264.027872 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4LtEtmlBGNa |
|---|---|
| Name | 4-Methyl-6-phenyl-1,3-dihydro-1H-2.lamada.6-thieno[3,4-C]thiophene-2,2-dione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 264.027871972 u |
| Formula | C13H12O2S2 |
| InChI | InChI=1S/C13H12O2S2/c1-9-11-7-17(14,15)8-12(11)13(16-9)10-5-3-2-4-6-10/h2-6H,7-8H2,1H3 |
| InChIKey | QXDWKZKXYJMMTF-UHFFFAOYSA-N |
| Molecular Weight | 264.357 g/mol |
| SMILES | C1=2C(=C(C)SC2C=2C=CC=CC2)CS(C1)(=O)=O |