4-Aminobenzotrifluoride(455-14-1) 1H NMR
Molecular FormulaC7H6F3N
Molecular Weight161.12
InChIInChI=1S/C7H6F3N/c8-7(9,10)5-1-3-6(11)4-2-5/h1-4H,11H2
InChIKey ODGIMMLDVSWADK-UHFFFAOYSA-N
SmilesC1(N)=CC=C(C(F)(F)F)C=C1
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Mass
MS-NW-1622
alpha,alpha,alpha-trifluoro-p-toluidine
C7H6F3N (Mass of molecular ion: 161)
Source Temperature: 240 °C
Sample Temperature: 180 °C
Reservoir, 75 eV
28.0 2.7
37.0 1.3
38.0 2.5
39.0 4.9
40.0 1.0
41.0 2.7
45.5 1.1
50.0 1.8
51.0 1.5
52.0 3.1
54.0 1.0
55.5 2.4
57.0 1.9
61.0 1.0
62.0 1.9
63.0 5.1
64.0 2.5
65.0 7.2
66.0 1.3
69.0 1.5
71.0 2.0
75.0 2.2
80.5 1.7
83.0 2.9
84.0 2.4
88.0 1.9
91.0 2.2
92.0 1.9
95.0 2.4
111.0 26.1
112.0 2.0
113.0 4.1
114.0 10.3
115.0 2.1
120.0 1.5
133.0 2.0
134.0 1.0
140.0 4.9
141.0 1.4
142.0 36.4
143.0 3.1
145.0 1.6
160.0 6.2
161.0 100.0
162.0 8.3