Molecule
![Molecular Image]()
13C nuclear magnetic resonance spectroscopy (13C NMR)
1H nuclear magnetic resonance spectroscopy (1H NMR)
electron ionisation mass spectrometry (EI-MS)
infrared absorption spectroscopy (IR)
thin-layer chromatography (TLC)
1-methoxy-4-(3,3,3-trifluoroprop-1-enyl)benzene
Chemical Information
| InChI | InChI=1S/C10H9F3O/c1-14-9-4-2-8(3-5-9)6-7-10(11,12)13/h2-7H,1H3 |
|---|---|
| SMILES | COc1ccc(cc1)C=CC(F)(F)F |
| InChI Key | SMILDTCRTVKJRM-UHFFFAOYSA-N |
| Exact Mass | 202.173 g/mol |
5 Related Dataset(s)
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Metadata Information
| Field | Value |
|---|---|
| NFDI4Chem Molecule ID | nfdi4chem-mol8342 |
| Source | |
| Alternate Name |
| Field | Value |
|---|---|
| No additional information available for this Dataset. | |
| Data-Source Molecule ID | Data-Source |
|---|---|
| 28288125 | surechembl |
| 54313211 | pubchem |
| The data in this table is sourced from UniChem at EBI. | |