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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: C11H7BrO2
Canonical SMILES: Brc1ccc2c(c1)ccc(c2)C(=O)O
InChI: InChI=1S/C11H7BrO2/c12-10-4-3-7-5-9(11(13)14)2-1-8(7)6-10/h1-6H,(H,13,14)
InChIKey: NPMCAVBMOTZUPD-UHFFFAOYSA-N
Exact Mass:
Crosslinks: 
Published on 2025-01-08
heteronuclear single quantum coherence (HSQC)
Author: 
Simone Gräßle1,2
1. Institute of Organic Chemistry, Karlsruhe Institute of Technology, Germany
2. Institute of Biological and Chemical Systems - Functional Molecular Systems, Karlsruhe Institute of Technology, Germany
Analysis DOI:
Analysis ID:
Datasets