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

Formula: C12H9I


Canonical SMILES:
Ic1ccccc1c1ccccc1
InChI:
InChI=1S/C12H9I/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9H
InChIKey:
QFUYDAGNUJWBSM-UHFFFAOYSA-N
Exact Mass:
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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 = 146.8 (Cquat, CArCAr), 144.4 (Cquat, CArCAr), 139.6 (+, CHAr), 130.2 (+, CHAr), 129.4 (+, CHAr), 128.9 (+, CHAr), 128.2 (+, CHAr), 128.1 (+, CHAr), 127.8 (+, CHAr), 98.8 (Cquat, CArI). In accordance with literature: D. Chen, G. Shi, H. Jiang, Y. Zhang, Y. Zhang, Org. Lett., 2016, 18, 2130–2133.
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