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

Formula: C36H44N2


Canonical SMILES:
N#Cc1c(C#N)c(ccc1c1cc(cc(c1)C(C)(C)C)C(C)(C)C)c1cc(cc(c1)C(C)(C)C)C(C)(C)C
InChI:
InChI=1S/C36H44N2/c1-33(2,3)25-15-23(16-26(19-25)34(4,5)6)29-13-14-30(32(22-38)31(29)21-37)24-17-27(35(7,8)9)20-28(18-24)36(10,11)12/h13-20H,1-12H3
InChIKey:
CFKZSKBEXBRRKD-UHFFFAOYSA-N
Exact Mass:
Crosslinks:   


Published on 2025-03-07This work is licensed under a Creative Commons Attribution-ShareAlike 4.0 International License.

 

1H nuclear magnetic resonance spectroscopy (1H NMR) 
Author: Lukas Langer1

1. IOC, Karlsruhe Institute of Technology, Deutschland

Analysis DOI:
Analysis ID:
Content:   
1H NMR (400 MHz, Chloroform-d [7.27 ppm], ppm) δ = 7.82 (s, 2H), 7.58 (t, 4J = 1.8 Hz, 2H), 7.44 (d, 4J = 1.8 Hz, 4H), 1.41 (s, 36H).
Datasets