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

Formula: C28H22N2O4


Canonical SMILES:
COC(=O)c1ccc(cc1)c1ccc(c(c1)/N=N/c1ccccc1)c1ccc(cc1)C(=O)OC
InChI:
InChI=1S/C28H22N2O4/c1-33-27(31)21-12-8-19(9-13-21)23-16-17-25(20-10-14-22(15-11-20)28(32)34-2)26(18-23)30-29-24-6-4-3-5-7-24/h3-18H,1-2H3/b30-29+
InChIKey:
ZXLPWFPKJLSDGY-QVIHXGFCSA-N
Exact Mass:
Crosslinks:   


Published on 2019-04-06This work is licensed under a Creative Commons Attribution-ShareAlike 4.0 International License.

 

13C nuclear magnetic resonance spectroscopy (13C NMR) 
Authors: Sylvain Grosjean1 - Sylvain Grosjean1 - Patrick Hodapp1

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

Analysis DOI:
Analysis ID:
Content:   
13C NMR (125 MHz, CDCl3, ppm) δ = 167.3 (1C, CO2CH3), 167.1 (1C, CO2CH3), 152.8 (1C, Cq), 150.0 (1C, Cq), 144.6 (1C, Cq), 143.2 (1C, Cq), 140.7 (1C, Cq), 139.9 (1C, Cq), 131.6 (1C, CH), 131.5 (1C, CH), 131.0 (2C, CH), 130.4 (2C, CH), 129.6 (1C, CH), 129.4 (2C, CH), 129.2 (1C, Cq), 129.1 (2C, CH), 128.5 (1C, Cq), 127.3 (2C, CH), 123.5 (2C, CH), 114.9 (1C, CH), 52.4 (2C, CO2CH3).
Datasets