| SpectraBase Compound ID | 5eXHd696LGU |
|---|---|
| InChI | InChI=1S/C8H6BrN3/c9-7-3-1-2-6(4-7)8-5-10-12-11-8/h1-5H,(H,10,11,12) |
| InChIKey | BKJXSQXZIOTRTP-UHFFFAOYSA-N |
| Mol Weight | 224.06 g/mol |
| Molecular Formula | C8H6BrN3 |
| Exact Mass | 222.97451 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BJ3f5556Ya1 |
|---|---|
| Name | BKJXSQXZIOTRTP-UHFFFAOYSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C8H6BrN3 |
| InChI | InChI=1S/C8H6BrN3/c9-7-3-1-2-6(4-7)8-5-10-12-11-8/h1-5H,(H,10,11,12) |
| InChIKey | BKJXSQXZIOTRTP-UHFFFAOYSA-N |
| Literature Reference Author | ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ |
| Literature Reference Citation | UNI_MAINZ,INTERNAL_DB(2006) |
| Molecular Weight | 224.060 g/mol |
| Source File Reference | MHKO2620 |