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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: C10H11BrO3
Canonical SMILES: CCOC(=O)c1cc(C)c(c(c1)O)Br
InChI: InChI=1S/C10H11BrO3/c1-3-14-10(13)7-4-6(2)9(11)8(12)5-7/h4-5,12H,3H2,1-2H3
InChIKey: HJPPCNABHLJUFL-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:
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