3,5-二硝基苯胺(618-87-1)核磁图(1HNMR)
InChI:InChI=1S/C6H5N3O4/c7-4-1-5(8(10)11)3-6(2-4)9(12)13/h1-3H,7H2
InChIKey: MPBZUKLDHPOCLS-UHFFFAOYSA-N
Smiles:C1(N)=CC([N+]([O-])=O)=CC([N+]([O-])=O)=C1
-
Mass
MS-NW-6504
3,5-dinitroaniline
C6H5N3O4 (Mass of molecular ion: 183)
Source Temperature: 170 °C
Sample Temperature: 150 °C
Direct, 75 eV
17.0 1.5
18.0 6.6
27.0 1.3
28.0 5.4
30.0 13.9
37.0 2.1
38.0 4.9
39.0 3.2
40.0 2.3
41.0 13.6
42.0 1.1
44.0 17.0
46.0 1.1
50.0 2.1
51.0 3.7
52.0 15.6
53.0 2.6
54.0 1.3
61.0 3.0
62.0 8.9
63.0 30.0
64.0 80.3
65.0 8.5
66.0 2.3
67.0 2.5
68.0 1.6
70.0 1.5
74.0 1.5
75.0 1.2
76.0 1.4
78.0 3.2
79.0 6.0
89.0 2.8
90.0 8.7
91.0 26.8
92.0 2.4
95.0 5.2
107.0 16.7
108.0 1.3
123.0 1.7
125.0 1.2
137.0 13.8
138.0 1.0
153.0 1.2
167.0 1.6
183.0 100.0
184.0 8.0
185.0 1.1