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This information is based on the molecular structure shown on the left side. For a decoupled sample, please refer to its individual details.
Formula: C5H3BrIN
Canonical SMILES: Brc1ccncc1I
InChI: InChI=1S/C5H3BrIN/c6-4-1-2-8-3-5(4)7/h1-3H
InChIKey: KDWZDHRURBJEIN-UHFFFAOYSA-N
Exact Mass:
Crosslinks: 
Published on 2024-05-27
1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
Author: 
Helena Šimek Tosino1,2
1. Institute of Organic Chemistry, Karlsruhe Institute of Technology, Germany
2. Institute of Biological and Chemical Systems - Functional Molecular Systems (IBCS-FMS), Karlsruhe Institute of Technology, Germany
Analysis DOI:
Analysis ID:
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