Molecule
![Molecular Image]()
13C nuclear magnetic resonance spectroscopy (13C NMR)
1H nuclear magnetic resonance spectroscopy (1H NMR)
attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR)
high-resolution electrospray ionisation time-of-flight mass spectrometry (HR-ESI-TOF-MS)
8-nitro-2-(tribromomethyl)quinoline
Chemical Information
| InChI | InChI=1S/C10H5Br3N2O2/c11-10(12,13)8-5-4-6-2-1-3-7(15(16)17)9(6)14-8/h1-5H |
|---|---|
| SMILES | [O-][N+](=O)c1cccc2c1nc(cc2)C(Br)(Br)Br |
| InChI Key | QLLLYNCAUWNZSY-UHFFFAOYSA-N |
| Exact Mass | 424.871 g/mol |
4 Related Dataset(s)
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Metadata Information
| Field | Value |
|---|---|
| NFDI4Chem Molecule ID | nfdi4chem-mol6903 |
| Source | |
| Alternate Name |
| Field | Value |
|---|---|
| No additional information available for this Dataset. | |
| Data-Source Molecule ID | Data-Source |
|---|---|
| CHEMBL2042567 | chembl |
| 70694485 | pubchem |
| The data in this table is sourced from UniChem at EBI. | |