This information is based on the molecular structure shown on the left side. For a decoupled sample, please refer to its individual details.

Formula: C7H6BrNO3


Canonical SMILES:
[O-][N+](=O)c1cc(O)c(cc1C)Br
InChI:
InChI=1S/C7H6BrNO3/c1-4-2-5(8)7(10)3-6(4)9(11)12/h2-3,10H,1H3
InChIKey:
UNDCYNWWVCTFES-UHFFFAOYSA-N
Exact Mass:
Crosslinks:   


Published on 2023-07-31No License

 

1H nuclear magnetic resonance spectroscopy (1H NMR) 
Author: Niklas Krappel1

1. IBCS-FMS, Karlsruhe Institute of Technology, Germany

Analysis DOI:
Analysis ID:
Content:   
1H NMR (400 MHz, Chloroform-d [7.27 ppm], ppm) δ = 7.67 (s, 1H), 7.49 (s, 1H), 5.62 (s, 1H), 2.53 (s, 3H).
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