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

Formula: C16H16N2O4


Canonical SMILES:
COC(=O)c1ccc(c(c1)N)c1ccc(cc1N)C(=O)OC
InChI:
InChI=1S/C16H16N2O4/c1-21-15(19)9-3-5-11(13(17)7-9)12-6-4-10(8-14(12)18)16(20)22-2/h3-8H,17-18H2,1-2H3
InChIKey:
CQJDGQODCKARGV-UHFFFAOYSA-N
Exact Mass:
Crosslinks:   


Published on 2019-04-09This work is licensed under a Creative Commons Attribution-ShareAlike 4.0 International License.

 

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

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

Analysis DOI:
Analysis ID:
Content:   
13C NMR (125 MHz, DMSO-d6, ppm) δ = 166.6 (2C, CO2CH3), 145.6 (2C, Cq), 130.8 (2C, CH), 129.7 (2C, Cq), 127.6 (2C, Cq), 117.2 (2C, CH), 115.9 (2C, CH), 52.0 (2C, CO2CH3).
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