对溴甲基苯甲酸(6232-88-8)红外图谱(IR1)
InChI:InChI=1S/C8H7BrO2/c9-5-6-1-3-7(4-2-6)8(10)11/h1-4H,5H2,(H,10,11)
InChIKey: CQQSQBRPAJSTFB-UHFFFAOYSA-N
Smiles:C(O)(=O)C1=CC=C(CBr)C=C1
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Mass
MS-NW-2418
alpha-bromo-p-toluic acid
C8H7BrO2 (Mass of molecular ion: 214)
Source Temperature: 220 °C
Sample Temperature: 130 °C
Direct, 75 eV
18.0 2.7
28.0 1.1
38.0 1.5
39.0 4.4
45.0 1.5
50.0 2.3
51.0 3.1
59.0 1.0
61.0 1.0
62.0 2.7
63.0 6.8
64.0 2.3
65.0 2.0
77.0 4.3
79.0 1.0
89.0 9.1
90.0 11.3
91.0 3.7
107.0 26.7
108.0 2.1
118.0 5.2
119.0 2.1
135.0 100.0
136.0 10.7
214.0 4.5
216.0 4.4