3,5-二氯吡啶-4-羧酸(13958-93-5)核磁圖(1HNMR)
InChI:InChI=1S/C6H3Cl2NO2/c7-3-1-9-2-4(8)5(3)6(10)11/h1-2H,(H,10,11)
InChIKey: BUQPTOSHKHYHHB-UHFFFAOYSA-N
Smiles:C1=NC=C(Cl)C(C(O)=O)=C1Cl
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Mass
MS-KW-0576
3,5-dichloroisonicotinic acid
C6H3Cl2NO2 (Mass of molecular ion: 191)
Source Temperature: 160 °C
Sample Temperature: 140 °C
Direct, 75 eV
18.0 1.5
28.0 3.6
36.0 4.9
37.0 3.7
38.0 3.5
44.0 6.2
45.0 7.0
47.0 2.0
48.0 1.6
49.0 11.0
50.0 8.8
51.0 1.9
55.5 4.8
56.5 1.6
60.0 2.9
62.0 1.9
65.0 1.0
72.0 1.6
73.0 6.8
74.0 3.2
75.0 7.0
76.0 8.0
77.0 1.4
77.5 1.5
83.0 1.5
84.0 54.3
85.0 10.9
86.0 18.1
87.0 5.0
92.0 1.3
100.0 1.3
101.0 1.1
110.0 8.0
111.0 31.9
112.0 17.7
113.0 10.7
114.0 5.0
119.0 9.7
120.0 2.4
121.0 6.3
122.0 1.4
123.0 1.1
128.0 1.5
146.0 11.9
147.0 7.3
148.0 8.2
149.0 4.6
150.0 1.5
156.0 2.8
158.0 1.0
163.0 1.1
174.0 46.1
175.0 3.2
176.0 29.5
177.0 2.1
178.0 4.9
191.0 100.0
192.0 7.3
193.0 63.8
194.0 4.7
195.0 10.5