Dataset
1H nuclear magnetic resonance spectroscopy (1H NMR)
Chemical Info
| InChI | InChI=1S/C10H5F3N2O3/c11-10(12,13)7-8(16)15-5-2-1-4(9(17)18)3-6(5)14-7/h1-3H,(H,15,16)(H,17,18) |
|---|---|
| SMILES | OC(=O)c1ccc2c(c1)nc(c(=O)[nH]2)C(F)(F)F |
| InChI Key | QCOIWEBIQVDGKJ-UHFFFAOYSA-N |
| Molecular Formula | C10H5F3N2O3 |
| Exact Mass | 258.154 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | 10.14272/QCOIWEBIQVDGKJ-UHFFFAOYSA-N/CHMO0000593 |
| License URL | |
| Source | https://www.chemotion-repository.net/inchikey/QCOIWEBIQVDGKJ-UHFFFAOYSA-N/CHMO0000593 |
| Version | |
| Author | Laura Holzhauer |
| Maintainer | Chemotion Repository |
| Language | english |
| MetadataCreated | 2025-03-15T03:11:00.272845 |
| MetadataModified | 2025-03-16T03:10:53.944957 |
| MetadataPublished | 2025-03-14 |
| Related Molecule |