硝冉酸(479-22-1)紅外圖譜(IR1)
InChI:InChI=1S/C6H2N2O8/c9-3-1(7(13)14)4(10)6(12)2(5(3)11)8(15)16/h9,12H
InChIKey: FDOKWKTVAJNFLT-UHFFFAOYSA-N
Smiles:C1(=O)C([N+]([O-])=O)=C(O)C(=O)C([N+]([O-])=O)=C1O
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Mass
MS-IW-3445
2,5-dihydroxy-3,6-dinitro-p-benzoquinone
C6H2N2O8 (Mass of molecular ion: 230)
Source Temperature: 160 °C
Sample Temperature: 150 °C
Direct, 75 eV
12.0 2.1
14.0 1.1
16.0 3.8
17.0 3.9
18.0 16.2
24.0 1.2
25.0 2.5
26.0 3.7
27.0 9.5
28.0 41.5
29.0 12.8
30.0 56.6
36.0 1.4
37.0 1.6
38.0 3.1
39.0 1.6
40.0 5.7
41.0 34.8
42.0 12.2
43.0 12.4
44.0 94.6
45.0 10.1
46.0 16.9
47.0 1.1
48.0 3.5
52.0 6.7
53.0 14.6
54.0 33.3
55.0 2.9
56.0 1.1
64.0 1.3
67.0 1.6
68.0 26.8
69.0 100.0
70.0 82.1
71.0 18.8
72.0 2.1
80.0 8.2
81.0 4.8
82.0 3.9
83.0 4.6
84.0 1.0
85.0 4.8
86.0 1.0
87.0 4.6
88.0 11.1
93.0 1.2
94.0 1.1
95.0 2.9
96.0 1.2
97.0 1.0
98.0 11.6
99.0 4.1
100.0 1.0
108.0 4.8
110.0 1.0
111.0 2.5
113.0 2.0
114.0 5.3
115.0 7.1
126.0 1.2
138.0 7.8
183.0 1.3
230.0 4.3