Dataset
1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
Chemical Information
| InChI | InChI=1S/C14H14O3S/c1-11-3-7-13(8-4-11)18(15,16)14-9-5-12(17-2)6-10-14/h3-10H,1-2H3 |
|---|---|
| SMILES | COc1ccc(cc1)S(=O)(=O)c1ccc(cc1)C |
| InChI Key | RHZGFTNGGQAHIQ-UHFFFAOYSA-N |
| Exact Mass | 262.324 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | 10.14272/RHZGFTNGGQAHIQ-UHFFFAOYSA-N/CHMO0001146 |
| License URL | |
| Source | https://www.chemotion-repository.net/inchikey/RHZGFTNGGQAHIQ-UHFFFAOYSA-N/CHMO0001146 |
| Version | |
| Author | José Carlos Ferreira da Cunha |
| Maintainer | Chemotion Repository |
| Language | english |
| MetadataPublished | 2026-01-20 |
| Related Molecule |
| Field | Value |
|---|---|
| Measurement Technique | 1H–13C heteronuclear single quantum coherence |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| 825670 | surechembl |
| 11139925 | pubchem |
| The data in this table is sourced from UniChem at EBI. | |