SpectraBase Spectrum ID |
4ibixxenYjN |
Name |
3,3,4,4,5,5,6,6,6-Nonafluoro-1-(2-(trifluoromethyl)phenyl)hexan-1-on |
Appearance |
Yellow liquid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
406.022702768 u |
Formula |
C13H6F12O |
InChI |
InChI=1S/C13H6F12O/c14-9(15,11(19,20)12(21,22)13(23,24)25)5-8(26)6-3-1-2-4-7(6)10(16,17)18/h1-4H,5H2 |
InChIKey |
KJJKULNBWODIOR-UHFFFAOYSA-N |
Instrument Name |
FINNIGAN SSQ or 7000 Thermo Deca XP |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/chem.202201830 |
Molecular Weight |
406.171 g/mol |
Quality |
468 |
Reported Formula |
C13H6OF12 |
SMILES |
C1=CC(=C(C=C1)C(F)(F)F)C(=O)CC(C(C(C(F)(F)F)(F)F)(F)F)(F)F |
SPLASH |
splash10-0il0-9520000000-7adbce35b34ba50d0fb3 |
Source of Spectrum |
QE-28-SM16-11 (DOI: 10.1002/chem.202201830) |
Wiley ID |
1900622 |