Dataset
heteronuclear single quantum coherence (HSQC)
Chemical Info
| InChI | InChI=1S/C8H9NO/c1-6-4-3-5-8(9-6)7(2)10/h3-5H,1-2H3 |
|---|---|
| SMILES | Cc1cccc(n1)C(=O)C |
| InChI Key | FPQMUQPPAYCAME-UHFFFAOYSA-N |
| Molecular Formula | C8H9NO |
| Exact Mass | 135.163 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | 10.14272/FPQMUQPPAYCAME-UHFFFAOYSA-N/CHMO0000604 |
| License URL | |
| Source | https://www.chemotion-repository.net/inchikey/FPQMUQPPAYCAME-UHFFFAOYSA-N/CHMO0000604 |
| Version | |
| Author | Simone Gräßle |
| Maintainer | Chemotion Repository |
| Language | english |
| MetadataCreated | 2025-02-04T13:30:11.769526 |
| MetadataModified | 2025-02-05T14:33:18.946779 |
| MetadataPublished | 2025-01-30 |
| Related Molecule |