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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: C7H9ClN2
Canonical SMILES: Cc1cc(N)c(c(c1)Cl)N
InChI: InChI=1S/C7H9ClN2/c1-4-2-5(8)7(10)6(9)3-4/h2-3H,9-10H2,1H3
InChIKey: UPFHQANNMQQOJI-UHFFFAOYSA-N
Exact Mass:
Crosslinks: 
Published on 2024-08-15
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