2,4-二硝基苯磺酸二水合物(89-02-1)質(zhì)譜(MS)
分子式:C6H4N2O7S
分子量: 248.17
InChI:InChI=1S/C6H4N2O7S/c9-7(10)4-1-2-6(16(13,14)15)5(3-4)8(11)12/h1-3H,(H,13,14,15)
InChIKey: OVOJUAKDTOOXRF-UHFFFAOYSA-N
Smiles:C1(S(O)(=O)=O)=CC=C([N+]([O-])=O)C=C1[N+]([O-])=O
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Mass
MS-IW-3879
2,4-dinitrobenzenesulfonic acid
C6H4N2O7S 2H2O (Mass of molecular ion: 248)
Source Temperature: 160 °C
Sample Temperature: 150 °C
Direct, 75 eV
17.0 2.1
18.0 10.5
28.0 7.0
29.0 1.1
30.0 100.0
37.0 5.0
38.0 10.2
39.0 9.8
44.0 3.3
45.0 3.5
46.0 14.9
48.0 4.4
49.0 1.7
50.0 9.0
51.0 13.0
52.0 10.0
53.0 36.9
54.0 2.4
55.0 3.0
61.0 6.2
62.0 26.0
63.0 63.7
64.0 25.3
65.0 32.1
66.0 2.6
67.0 2.0
68.0 2.0
69.0 5.3
73.0 6.6
74.0 53.4
75.0 51.3
76.0 7.5
77.0 2.6
78.0 1.6
79.0 21.5
80.0 9.4
81.0 1.6
82.0 1.3
88.0 1.3
90.0 4.8
91.0 44.9
92.0 29.0
93.0 7.1
94.0 1.0
95.0 2.0
107.0 8.3
108.0 7.5
109.0 1.0
111.0 1.0
120.0 1.0
121.0 8.0
122.0 9.8
135.0 1.8
137.0 1.0
138.0 5.3
151.0 1.6
154.0 10.4
155.0 1.4
167.0 20.5
168.0 40.1
169.0 3.0
184.0 37.2
185.0 3.0
202.0 1.2
218.0 1.0
231.0 1.3
232.0 3.2
248.0 71.9
249.0 6.2
250.0 4.6