| SpectraBase Compound ID | DE2lq5WvDJD |
|---|---|
| InChI | InChI=1S/C7H5BrF3N/c8-5-3-4(7(9,10)11)1-2-6(5)12/h1-3H,12H2 |
| InChIKey | QKRJIXSZTKOFTD-UHFFFAOYSA-N |
| Mol Weight | 240.02 g/mol |
| Molecular Formula | C7H5BrF3N |
| Exact Mass | 238.955747 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3LAU4Yku23G |
|---|---|
| Name | QKRJIXSZTKOFTD-UHFFFAOYSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C7H5BrF3N |
| InChI | InChI=1S/C7H5BrF3N/c8-5-3-4(7(9,10)11)1-2-6(5)12/h1-3H,12H2 |
| InChIKey | QKRJIXSZTKOFTD-UHFFFAOYSA-N |
| Literature Reference Author | ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ |
| Literature Reference Citation | UNI_MAINZ,INTERNAL_DB(2007) |
| Molecular Weight | 240.023 g/mol |
| Source File Reference | MHKO11958 |