Dataset
19F nuclear magnetic resonance spectroscopy (19F NMR)
Chemical Information
| InChI | InChI=1S/C15H9F3O2/c16-15(17,18)12-8-6-11(7-9-12)14(20)13(19)10-4-2-1-3-5-10/h1-9H |
|---|---|
| SMILES | O=C(C(=O)c1ccccc1)c1ccc(cc1)C(F)(F)F |
| InChI Key | BPFIQBYBWZLIJI-UHFFFAOYSA-N |
| Exact Mass | 278.226 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | 10.14272/BPFIQBYBWZLIJI-UHFFFAOYSA-N/CHMO0000597 |
| License URL | |
| Source | https://www.chemotion-repository.net/inchikey/BPFIQBYBWZLIJI-UHFFFAOYSA-N/CHMO0000597 |
| Version | |
| Author | Stefan Bräse |
| Maintainer | Chemotion Repository |
| Language | english |
| MetadataPublished | 2026-02-03 |
| Related Molecule |
| Field | Value |
|---|---|
| Measurement Technique | 19F nuclear magnetic resonance spectroscopy |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| 2834217 | surechembl |
| 11821931 | pubchem |
| The data in this table is sourced from UniChem at EBI. | |