Hexachloroacetone(116-16-5) 1H NMR
Molecular FormulaC3Cl6O
Molecular Weight264.75
InChIInChI=1S/C3Cl6O/c4-2(5,6)1(10)3(7,8)9
InChIKey DOJXGHGHTWFZHK-UHFFFAOYSA-N
SmilesC(Cl)(Cl)(Cl)C(=O)C(Cl)(Cl)Cl
-
Mass
MS-NW-0786
hexachloroacetone
C3Cl6O (Mass of molecular ion: 262)
Source Temperature: 220 °C
Sample Temperature: 150 °C
Reservoir, 75 eV
28.0 3.5
35.0 3.0
36.0 3.0
47.0 14.0
49.0 4.6
59.0 2.1
63.0 5.4
65.0 1.8
71.0 1.2
82.0 19.9
83.0 5.3
84.0 13.0
85.0 2.9
86.0 2.0
87.0 1.3
94.0 3.6
96.0 2.7
110.0 6.8
111.0 1.7
112.0 4.4
113.0 1.1
117.0 100.0
118.0 1.1
119.0 96.6
120.0 1.0
121.0 30.5
123.0 3.3
129.0 1.7
131.0 1.8
145.0 9.1
147.0 8.6
149.0 2.7
164.0 2.6
166.0 3.6
168.0 1.8
199.0 3.2
201.0 5.1
203.0 3.3
205.0 1.1
227.0 1.1
229.0 1.7
231.0 1.1