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

Formula: C11H10N2O3S


Canonical SMILES:
O=C1N/C(=C/c2ccc(cc2)[N+](=O)[O-])/SC1C
InChI:
InChI=1S/C11H10N2O3S/c1-7-11(14)12-10(17-7)6-8-2-4-9(5-3-8)13(15)16/h2-7H,1H3,(H,12,14)/b10-6-
InChIKey:
PGDGUAOXLLTZJC-POHAHGRESA-N
Exact Mass:
Crosslinks:   


Published on 2023-11-07No License

 

1H nuclear magnetic resonance spectroscopy (1H NMR) 
Authors: Henrike Zacher1 - Eric Täuscher2

1. Fachgebiet Chemie, Technische Universität Ilmenau, Deutschland

2. Chemie und Biotechnik, Technische Universität Ilmenau, Germany

Analysis DOI:
Analysis ID:
Content:   
1H NMR (300 MHz, DMSO-d6 [2.50 ppm], ppm) δ = 11.36 (s, 1H), 8.18–8.13 (m, 2H), 7.46–7.42 (m, 2H), 6.14 (s, 1H), 4.31 (q, J = 7.2 Hz, 1H), 1.51 (d, J = 7.2 Hz, 3H).
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