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

Formula: C19H9F19N2O


Canonical SMILES:
Cc1nc2ccccc2nc1OCC(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
InChI:
InChI=1S/C19H9F19N2O/c1-7-10(40-9-5-3-2-4-8(9)39-7)41-6-11(20,21)12(22,23)13(24,25)14(26,27)15(28,29)16(30,31)17(32,33)18(34,35)19(36,37)38/h2-5H,6H2,1H3
InChIKey:
DBMJWYDGWNZVSX-UHFFFAOYSA-N
Exact Mass:
Crosslinks:   


Published on 2021-12-09This work is licensed under a Creative Commons Attribution-ShareAlike 4.0 International License.

 

19F nuclear magnetic resonance spectroscopy (19F NMR) 
Author: Jérôme Klein1

1. Institut of Toxicology and Genetics, Karlsruhe Institute of Technology, Germany

Analysis DOI:
Analysis ID:
Content:   
19F NMR (377 MHz, CDCl3, ppm) δ = -80.78 (t, J = 9.7 Hz, CF3), -119.07 (t, J = 13.1 Hz, CF2), -121.25 – -122.14 (m, 4 x CF2), -122.47 – -122.91 (m, CF2),-122.90 – -123.34 (m, CF2), -125.46 – -126.39 (m, CF2).
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