Dataset
1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
Chemical Info
| InChI | InChI=1S/C19H16O5/c1-23-19(12-15(20)13-8-4-2-5-9-13)16(17(21)18(22)24-19)14-10-6-3-7-11-14/h2-11,21H,12H2,1H3 |
|---|---|
| SMILES | COC1(CC(=O)c2ccccc2)OC(=O)C(=C1c1ccccc1)O |
| InChI Key | ZSQDINYGPVLTCM-UHFFFAOYSA-N |
| Molecular Formula | C19H16O5 |
| Exact Mass | 324.327 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | 10.14272/ZSQDINYGPVLTCM-UHFFFAOYSA-N/CHMO0001148 |
| License URL | |
| Source | https://www.chemotion-repository.net/inchikey/ZSQDINYGPVLTCM-UHFFFAOYSA-N/CHMO0001148 |
| Version | |
| Author | Anja Schueffler |
| Maintainer | Chemotion Repository |
| Language | english |
| MetadataCreated | 2025-04-06T02:02:09.353811 |
| MetadataModified | 2025-04-06T02:17:12.156664 |
| MetadataPublished | 2025-04-03 |
| Related Molecule |