6,6ˊ-二硫二煙酸(15658-35-2)紅外圖譜(IR1)
分子式:C12H8N2O4S2
分子量: 308.33
InChI:InChI=1S/C12H8N2O4S2/c15-11(16)7-1-3-9(13-5-7)19-20-10-4-2-8(6-14-10)12(17)18/h1-6H,(H,15,16)(H,17,18)
InChIKey: GSASOFRDSIKDSN-UHFFFAOYSA-N
Smiles:C1(C(=O)O)=CN=C(SSC2=NC=C(C(=O)O)C=C2)C=C1
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Mass
MS-NW-6929
6,6'-dithiodinicotinic acid
C12H8N2O4S2 (Mass of molecular ion: 308)
Source Temperature: 230 °C
Sample Temperature: 200 °C
Direct, 75 eV
18.0 1.1
26.0 2.0
27.0 2.9
28.0 4.5
32.0 1.3
37.0 3.7
38.0 7.6
39.0 23.8
40.0 1.8
41.0 1.1
44.0 6.4
45.0 16.2
49.0 2.2
50.0 11.9
51.0 22.8
52.0 7.8
53.0 5.0
54.0 3.1
55.0 2.1
57.0 7.0
58.0 3.8
59.0 1.6
60.0 2.1
63.0 1.1
64.0 6.5
65.0 2.1
66.0 7.0
67.0 9.1
68.0 1.1
69.0 6.0
70.0 2.6
71.0 3.0
72.0 1.1
75.0 2.4
76.0 4.4
77.0 4.0
78.0 18.3
79.0 3.1
80.0 1.5
81.0 6.8
82.0 12.7
83.0 12.8
84.0 4.6
85.0 2.0
86.0 1.8
88.0 1.0
92.0 1.1
93.0 1.5
94.0 23.2
95.0 3.4
98.0 1.5
99.0 1.4
104.0 1.2
105.0 1.5
108.0 4.5
109.0 8.9
110.0 15.7
111.0 44.8
112.0 3.6
120.0 2.2
121.0 1.3
122.0 18.4
123.0 3.8
126.0 1.0
127.0 2.5
128.0 1.2
136.0 6.0
137.0 2.8
138.0 9.1
139.0 1.8
141.0 2.0
154.0 16.2
155.0 100.0
156.0 10.9
157.0 5.8
169.0 1.0
171.0 1.7
172.0 2.5
173.0 1.0
183.0 3.1
185.0 1.2
186.0 4.7
187.0 1.8
188.0 1.3
198.0 2.3
199.0 6.5
200.0 5.3
214.0 1.6
215.0 1.2
226.0 1.9
227.0 11.1
228.0 2.0
229.0 2.1
231.0 1.9
242.0 1.5
243.0 11.6
244.0 10.7
245.0 1.6
256.0 1.2
263.0 1.3
274.0 3.0
275.0 16.1
276.0 5.0
277.0 1.5
291.0 1.0
306.0 1.3
307.0 18.2
308.0 72.7
309.0 13.7
310.0 8.7
311.0 1.3