丙二酸雙(4-硝基苯甲基)酯(67245-85-6)紅外圖譜(IR2)
分子式:C17H14N2O8
分子量: 374.3
InChI:InChI=1S/C17H14N2O8/c20-16(26-10-12-1-5-14(6-2-12)18(22)23)9-17(21)27-11-13-3-7-15(8-4-13)19(24)25/h1-8H,9-11H2
InChIKey: RBVOYZBIDZCDBO-UHFFFAOYSA-N
Smiles:C(OCC1=CC=C([N+]([O-])=O)C=C1)(=O)CC(OCC1=CC=C([N+]([O-])=O)C=C1)=O
-
Mass
MS-IW-7564
bis(4-nitrobenzyl) malonate
C17H14N2O8 (Mass of molecular ion: 374)
Source Temperature: 180 °C
Sample Temperature: 210 °C
Direct, 75 eV
17.0 1.4
18.0 6.0
27.0 2.4
28.0 8.6
29.0 1.7
30.0 12.0
31.0 1.8
38.0 1.4
39.0 5.3
40.0 1.9
41.0 2.4
42.0 4.4
43.0 3.2
44.0 8.3
50.0 6.3
51.0 12.7
52.0 3.8
53.0 2.3
55.0 1.0
62.0 1.8
63.0 8.1
64.0 2.7
65.0 2.1
66.0 1.4
68.0 2.9
69.0 14.5
70.0 2.7
74.0 2.3
75.0 2.8
76.0 4.5
77.0 28.8
78.0 24.9
79.0 7.5
87.0 30.3
88.0 1.4
89.0 34.1
90.0 17.5
91.0 3.5
92.0 1.6
94.0 3.2
95.0 1.1
104.0 1.7
105.0 7.6
106.0 30.7
107.0 17.2
108.0 7.5
120.0 5.0
121.0 3.0
122.0 2.8
123.0 1.1
124.0 3.8
125.0 1.2
135.0 2.2
136.0 41.5
137.0 100.0
138.0 8.3
150.0 3.2
151.0 2.8
152.0 24.2
153.0 86.4
154.0 7.4
176.0 1.0
221.0 2.4