Dataset
1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
Chemical Info
| InChI | InChI=1S/C8H7NO4/c9-6-2-4(7(10)11)1-5(3-6)8(12)13/h1-3H,9H2,(H,10,11)(H,12,13) |
|---|---|
| SMILES | Nc1cc(cc(c1)C(=O)O)C(=O)O |
| InChI Key | KBZFDRWPMZESDI-UHFFFAOYSA-N |
| Exact Mass | 181.145 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | 10.14272/KBZFDRWPMZESDI-UHFFFAOYSA-N/CHMO0001148 |
| License URL | |
| Source | https://www.chemotion-repository.net/inchikey/KBZFDRWPMZESDI-UHFFFAOYSA-N/CHMO0001148 |
| Version | |
| Author | Alex Johnson |
| Maintainer | Chemotion Repository |
| Language | english |
| MetadataCreated | 2024-09-08T04:27:57.560994 |
| MetadataModified | 2024-09-23T09:26:12.484534 |
| MetadataPublished | 2024-08-08 |
| Related Molecule |