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

Formula: C13H22N6


Canonical SMILES:
CN(CCCNc1ncnc2c1ncn2C(C)C)C
InChI:
InChI=1S/C13H22N6/c1-10(2)19-9-17-11-12(15-8-16-13(11)19)14-6-5-7-18(3)4/h8-10H,5-7H2,1-4H3,(H,14,15,16)
InChIKey:
DYIJRFOKZWKRSU-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) 
Authors: Simone Gräßle - Nicole Jung
Analysis DOI:
Analysis ID:
Content:   
1H NMR (400 MHz, Methanol-d4), δ = 8.24 (s, 1 H), 8.17 (s, 1 H), 4.81 (p, J = 6.8 Hz,  1 H), 3.64 (s, 2 H), 2.52 – 2.42 (m, 2 H), 2.27 (s, 6 H), 1.92 – 1.85 (m, 2 H), 1.60 (d, J = 6.8 Hz, 6 H).
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