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

Formula: C8H5N3O4


Canonical SMILES:
N#[N+][N-]c1cc(ccc1C(=O)O)C(=O)O
InChI:
InChI=1S/C8H5N3O4/c9-11-10-6-3-4(7(12)13)1-2-5(6)8(14)15/h1-3H,(H,12,13)(H,14,15)
InChIKey:
IUGMVBUDECYPGB-UHFFFAOYSA-N
Exact Mass:
Crosslinks:   


Published on 2014-05-27This work is licensed under a Creative Commons Attribution-ShareAlike 4.0 International License.

 

1H nuclear magnetic resonance spectroscopy (1H NMR) 
Author: Sylvain Grosjean
Analysis DOI:
Analysis ID:
Content:   
1H-NMR (d6-DMSO, 500 MHz): δ = 13.45(b-s, 2H, CO2H), 7.84 (d,1H, J = 8.5 Hz, CHAr), 7.78-7.76 (m, 2H, CHAr) ppm.
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