Dataset
heteronuclear single quantum coherence (HSQC)
Chemical Info
| InChI | InChI=1S/C6H4ClF3N2/c7-4-1-3(6(8,9)10)2-12-5(4)11/h1-2H,(H2,11,12) |
|---|---|
| SMILES | Nc1ncc(cc1Cl)C(F)(F)F |
| InChI Key | WXNPZQIRDCDLJD-UHFFFAOYSA-N |
| Molecular Formula | C6H4ClF3N2 |
| Exact Mass | 196.558 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | 10.14272/WXNPZQIRDCDLJD-UHFFFAOYSA-N/CHMO0000604 |
| License URL | |
| Source | https://www.chemotion-repository.net/inchikey/WXNPZQIRDCDLJD-UHFFFAOYSA-N/CHMO0000604 |
| Version | |
| Author | Simone Gräßle |
| Maintainer | Chemotion Repository |
| Language | english |
| MetadataCreated | 2025-02-04T13:27:33.156959 |
| MetadataModified | 2025-02-04T13:27:33.156967 |
| MetadataPublished | 2025-01-08 |
| Related Molecule |