Dataset
1H nuclear magnetic resonance spectroscopy (1H NMR)
Chemical Information
| InChI | InChI=1S/C16H10F3NO/c1-2-11-3-5-12(6-4-11)13-7-9-14(10-8-13)15(20-21)16(17,18)19/h1,3-10,21H/b20-15- |
|---|---|
| SMILES | O/N=C(\C(F)(F)F)/c1ccc(cc1)c1ccc(cc1)C#C |
| InChI Key | BFJVHIAKXGWTJT-HKWRFOASSA-N |
| Molecular Formula | C16H10F3NO |
| Exact Mass | 289.252 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | 10.14272/BFJVHIAKXGWTJT-HKWRFOASSA-N/NMR/1H/CDCl3/250.1 |
| License URL | |
| Source | https://www.chemotion-repository.net/inchikey/BFJVHIAKXGWTJT-HKWRFOASSA-N/NMR/1H/CDCl3/250.1 |
| Version | |
| Author | Irina Protasova |
| Maintainer | Chemotion Repository |
| Language | english |
| MetadataPublished | 2015-02-25 |
| Related Molecule |
|
| Field | Value |
|---|---|
| Measurement Technique | 1H nuclear magnetic resonance spectroscopy |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| 90645636 | pubchem |
| The data in this table is sourced from UniChem at EBI. | |