Dataset
13C nuclear magnetic resonance spectroscopy (13C NMR)
Chemical Info
| InChI | InChI=1S/C18H12O3/c19-15-11-14(12-7-3-1-4-8-12)17(20)18(21)16(15)13-9-5-2-6-10-13/h1-11,21H |
|---|---|
| SMILES | O=C1C=C(c2ccccc2)C(=O)C(=C1c1ccccc1)O |
| InChI Key | GXMJKXBNCXNACS-UHFFFAOYSA-N |
| Molecular Formula | C18H12O3 |
| Exact Mass | 276.286 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | 10.14272/GXMJKXBNCXNACS-UHFFFAOYSA-N/CHMO0000595 |
| License URL | |
| Source | https://www.chemotion-repository.net/inchikey/GXMJKXBNCXNACS-UHFFFAOYSA-N/CHMO0000595 |
| Version | |
| Author | Anja Schueffler |
| Maintainer | Chemotion Repository |
| Language | english |
| MetadataCreated | 2025-04-06T02:03:01.459789 |
| MetadataModified | 2025-04-06T02:18:04.363129 |
| MetadataPublished | 2025-04-03 |
| Related Molecule |