2-三氟甲基苯甲酸(433-97-6)核磁图(1HNMR)
InChI:InChI=1S/C8H5F3O2/c9-8(10,11)6-4-2-1-3-5(6)7(12)13/h1-4H,(H,12,13)
InChIKey: FBRJYBGLCHWYOE-UHFFFAOYSA-N
Smiles:C(O)(=O)C1=CC=CC=C1C(F)(F)F
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![图谱](https://www.chemicalbook.com/Spectrum/433-97-6_MS.gif)
Mass
MS-NW-9599
o-(trifluoromethyl)benzoic acid
C8H5F3O2 (Mass of molecular ion: 190)
Source Temperature: 250 °C
Sample Temperature: 150 °C
Reservoir, 75 eV
28.0 1.0
38.0 1.3
39.0 1.8
45.0 2.1
50.0 6.3
51.0 3.6
57.0 1.8
62.0 1.0
63.0 2.3
69.0 3.1
74.0 3.5
75.0 11.1
76.0 3.6
77.0 2.3
94.0 2.3
95.0 14.9
96.0 5.1
99.0 2.1
104.0 1.4
107.0 1.5
114.0 2.5
119.0 1.2
122.0 1.1
123.0 2.7
125.0 8.6
126.0 10.4
127.0 4.2
142.0 2.7
143.0 1.2
144.0 1.4
145.0 60.1
146.0 5.1
150.0 5.2
151.0 8.2
170.0 6.0
173.0 100.0
174.0 8.9
190.0 73.1
191.0 6.6