| SpectraBase Compound ID | ALJ0V7XVazN |
|---|---|
| InChI | InChI=1S/C12H8BrN/c13-8-5-6-12-10(7-8)9-3-1-2-4-11(9)14-12/h1-7,14H |
| InChIKey | LTBWKAYPXIIVPC-UHFFFAOYSA-N |
| Mol Weight | 246.11 g/mol |
| Molecular Formula | C12H8BrN |
| Exact Mass | 244.984012 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2aqkTUfpNeU |
|---|---|
| Name | LTBWKAYPXIIVPC-UHFFFAOYSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C12H8BrN |
| InChI | InChI=1S/C12H8BrN/c13-8-5-6-12-10(7-8)9-3-1-2-4-11(9)14-12/h1-7,14H |
| InChIKey | LTBWKAYPXIIVPC-UHFFFAOYSA-N |
| Literature Reference Author | ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ |
| Literature Reference Citation | UNI_MAINZ,INTERNAL_DB(2006) |
| Molecular Weight | 246.106 g/mol |
| Source File Reference | MHKO20550 |