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

Formula: C24H18S2


Canonical SMILES:
c1ccc(cc1)c1ccccc1SSc1ccccc1c1ccccc1
InChI:
InChI=1S/C24H18S2/c1-3-11-19(12-4-1)21-15-7-9-17-23(21)25-26-24-18-10-8-16-22(24)20-13-5-2-6-14-20/h1-18H
InChIKey:
JKPTZWVDCSARTM-UHFFFAOYSA-N
Exact Mass:
Crosslinks:   


Published on 2019-02-22This work is licensed under a Creative Commons Attribution-ShareAlike 4.0 International License.

 

13C nuclear magnetic resonance spectroscopy (13C NMR) 
Author: Robin Bär1

1. Institute of Organic Chemistry, Karlsruhe Institute of Technology, Germany

Analysis DOI:
Analysis ID:
Content:   
13C NMR (100 MHz, CDCl3, ppm) δ =  141.4 (Cquat, 2xCAr), 139.8 (Cquat, 2xCAr), 135.1 (Cquat, 2xCAr), 130.2 (+, 2xCHAr), 129.7 (+, 4xCHAr), 128.4 (+, 2xCHAr), 128.4 (+, 4xCHAr), 127.9 (+, 2xCHAr), 127.3 (+, 2xCHAr), 126.7 (+, 2xCHAr). In accordance with literature: K. Nishino, Y. Ogiwara, N. Sakai, Eur. J. Org. Chem., 2017, 2017, 5892–5895.
Datasets