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

Formula: C24H21NO2S


Canonical SMILES:
COc1ccc(cc1)N(c1ccc(cc1)OC)c1ccc(cc1)c1cccs1
InChI:
InChI=1S/C24H21NO2S/c1-26-22-13-9-20(10-14-22)25(21-11-15-23(27-2)16-12-21)19-7-5-18(6-8-19)24-4-3-17-28-24/h3-17H,1-2H3
InChIKey:
XYJCIDLTSVUDLE-UHFFFAOYSA-N
Exact Mass:
Crosslinks:   


Published on 2025-02-26This work is licensed under a Creative Commons Attribution 4.0 International License.

 

1H nuclear magnetic resonance spectroscopy (1H NMR) 
Author: Henrik Tappert1

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

Analysis DOI:
Analysis ID:
Content:   
1H NMR (400 MHz, THF-d8 [3.58 ppm], ppm) δ = 7.42–7.38 (m, 2H, CHAr), 7.23 (dd, J = 5.1 Hz, J = 1.1 Hz, 1H, CHAr), 7.21 (dd, J = 3.6 Hz, J = 1.2 Hz, 1H, CHAr), 7.07–6.96 (m, 5H, CHAr), 6.89–6.78 (m, 6H, CHAr), 3.74 (s, 6H, OMe-CH3). Impurities: 2.46 ppm (water).
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