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

Formula: C15H11F6N5


Canonical SMILES:
FC(Cn1cnc2c1ncnc2NCc1cccc(c1)C(F)(F)F)(F)F
InChI:
InChI=1S/C15H11F6N5/c16-14(17,18)6-26-8-25-11-12(23-7-24-13(11)26)22-5-9-2-1-3-10(4-9)15(19,20)21/h1-4,7-8H,5-6H2,(H,22,23,24)
InChIKey:
DBALJAXTFXCNRG-UHFFFAOYSA-N
Exact Mass:
Crosslinks:   


Published on 2014-05-27This work is licensed under a Creative Commons Attribution-ShareAlike 4.0 International License.

 

infrared absorption spectroscopy (IR) 
Author: Simone Gräßle
Analysis DOI:
Analysis ID:
Content:   
IR (ATR): ν˜ = 3272,2973, 1636, 1590, 1542, 1483, 1443, 1426, 1399, 1383, 1325, 1293, 1281, 1257,1235, 1213, 1160, 1124, 1093, 1072, 977, 934, 922, 898, 855, 834, 805, 788, 752,735, 701, 668, 649, 636, 573, 522, 469, 436cm–1.
Datasets