3,5-Dichlorobenzoic acid(51-36-5) Raman
Molecular FormulaC7H4Cl2O2
Molecular Weight191.01
InChIInChI=1S/C7H4Cl2O2/c8-5-1-4(7(10)11)2-6(9)3-5/h1-3H,(H,10,11)
InChIKey CXKCZFDUOYMOOP-UHFFFAOYSA-N
SmilesC(O)(=O)C1=CC(Cl)=CC(Cl)=C1
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Mass
MS-NW-4802
3,5-dichlorobenzoic acid
C7H4Cl2O2 (Mass of molecular ion: 190)
Source Temperature: 260 °C
Sample Temperature: 180 °C
Reservoir, 75 eV
18.0 1.6
28.0 1.9
36.0 2.4
37.0 4.7
38.0 2.3
39.0 1.1
44.0 1.1
45.0 4.5
49.0 2.5
50.0 8.6
51.0 2.2
53.0 1.3
54.5 2.9
55.0 2.9
55.5 1.1
56.0 1.0
60.0 1.0
61.0 1.9
62.0 1.7
63.0 4.1
72.0 1.2
72.5 1.9
73.0 7.0
73.5 1.2
74.0 19.5
75.0 20.8
76.0 1.8
77.0 1.2
84.0 4.0
85.0 3.2
86.0 1.6
86.5 2.3
87.0 1.4
87.5 1.4
98.0 1.0
99.0 6.2
101.0 2.2
108.0 1.1
109.0 15.6
110.0 6.1
111.0 11.5
112.0 2.5
113.0 2.5
144.0 1.7
145.0 35.1
146.0 4.4
147.0 22.0
148.0 2.7
149.0 3.7
155.0 2.7
162.0 1.4
172.0 1.3
173.0 77.2
174.0 6.8
175.0 48.7
176.0 4.0
177.0 8.2
190.0 100.0
191.0 8.3
192.0 64.3
193.0 5.3
194.0 10.6