丁二腈(110-61-2)ESR圖譜
InChI:InChI=1S/C4H4N2/c5-3-1-2-4-6/h1-2H2
InChIKey: IAHFWCOBPZCAEA-UHFFFAOYSA-N
Smiles:C(#N)CCC#N
-
Mass
MS-NW-1693
succinonitrile
C4H4N2 (Mass of molecular ion: 80)
Source Temperature: 240 °C
Sample Temperature: 180 °C
Reservoir, 75 eV
12.0 1.0
13.0 1.0
18.0 1.3
25.0 1.8
26.0 11.4
27.0 5.2
28.0 8.1
36.0 1.0
37.0 2.4
38.0 6.4
39.0 6.8
40.0 46.7
41.0 4.5
50.0 2.8
51.0 16.2
52.0 27.5
53.0 100.0
54.0 9.2
76.0 2.0
77.0 3.1
79.0 36.3
80.0 20.0
81.0 1.1
-
| 1H NMR |
300 MHz |
| C4 H4 N2
|
0.043 g : 0.5 ml CDCl3
|
| succinonitrile
|
 |
Parameter ppm Hz
D(A) 2.763
|
Hz ppm Int.
828.90 2.763 1000
UV PHOTOLYSIS IN H2O2, H2O, 33C