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.

 

infrared absorption spectroscopy (IR) 
Author: Jérôme Klein1

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

Analysis DOI:
Analysis ID:
Content:   
IR (ATR, ṽ) = 3055, 2970, 1609, 1589, 1502, 1458, 1422, 1398, 1375, 1360, 1329, 1298, 1278, 1227, 1201, 1184, 1147, 1122, 1098, 1060, 1017, 965, 941, 931, 874, 819, 786, 761, 747, 708, 679, 650, 630, 612 cm–1.
Datasets