三乙烯二胺(280-57-9)質(zhì)譜(MS)
InChI:InChI=1S/C6H12N2/c1-2-8-5-3-7(1)4-6-8/h1-6H2
InChIKey: IMNIMPAHZVJRPE-UHFFFAOYSA-N
Smiles:N12CCN(CC1)CC2
-
Mass
MS-NW-1392
1,4-diazabicyclo(2.2.2)octane
C6H12N2 (Mass of molecular ion: 112)
Source Temperature: 260 °C
Sample Temperature: 180 °C
Reservoir, 75 eV
15.0 13.3
18.0 1.3
26.0 3.1
27.0 11.4
28.0 23.4
29.0 18.3
30.0 10.7
39.0 1.6
40.0 1.8
41.0 12.1
42.0 100.0
43.0 4.2
44.0 8.2
54.0 7.7
55.0 82.8
56.0 37.8
57.0 54.2
58.0 28.9
59.0 1.2
68.0 2.7
69.0 7.7
70.0 16.6
71.0 1.1
82.0 5.1
83.0 7.4
84.0 12.2
85.0 2.6
97.0 3.1
111.0 2.6
112.0 66.8
113.0 5.4
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| 1H NMR |
300 MHz |
| C6 H12 N2
|
0.051 g : 0.5 ml CDCl3
|
| 1,4-diazabicyclo(2.2.2)octane
|
 |
Parameter ppm Hz
D(A) 2.786
|
Hz ppm Int.
835.80 2.786 1000
CATION RADICAL, ELECTROOXIDATION IN CH3CN