alpha-甲基-alpha-丙基琥珀酰亞胺(1497-19-4)紅外圖譜(IR1)
InChI:InChI=1S/C8H13NO2/c1-3-4-8(2)5-6(10)9-7(8)11/h3-5H2,1-2H3,(H,9,10,11)
InChIKey: VXXGMHKGORIRTK-UHFFFAOYSA-N
Smiles:N1C(=O)CC(C)(CCC)C1=O
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Mass
MS-NW-6669
alpha-methyl-alpha-propylsuccinimide
C8H13NO2 (Mass of molecular ion: 155)
Source Temperature: 260 °C
Sample Temperature: 190 °C
Reservoir, 75 eV
15.0 1.0
18.0 2.3
27.0 8.0
28.0 2.9
29.0 8.2
38.0 1.1
39.0 11.4
40.0 3.3
41.0 21.5
42.0 9.2
43.0 3.9
44.0 2.5
53.0 3.1
54.0 1.2
55.0 15.2
56.0 59.8
57.0 3.0
67.0 2.2
68.0 1.4
69.0 18.1
70.0 1.6
83.0 1.0
84.0 6.5
85.0 12.7
98.0 4.8
112.0 3.7
113.0 100.0
114.0 6.6
126.0 1.5
400 MHz in CDCl3
90 MHz in CDCl3
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| 1H NMR |
399.65 MHz |
| C8 H13 N O2
|
0.035 g : 0.5 ml CDCl3
|
| alpha-methyl-alpha-propylsuccinimide
|
 |
Assign. Shift(ppm)
A 9.14
B *1 2.676
C *1 2.480
D *2 1.656
E *2 1.546
F *3 1.38
G 1.319
J *3 1.234
K 0.939
|
Hz ppm Int.
1080.63 2.704 178
1062.32 2.659 265
998.84 2.500 288
980.53 2.454 195
679.17 1.700 30
674.44 1.688 35
666.81 1.669 46
665.59 1.666 59
662.08 1.657 51
660.86 1.654 60
653.38 1.635 69
648.65 1.624 66
632.02 1.582 48
627.59 1.571 60
619.66 1.551 65
615.23 1.540 73
606.08 1.517 39
601.65 1.506 39
557.25 1.395 37
552.37 1.383 37
549.93 1.377 38
545.04 1.364 45
537.57 1.346 32
532.68 1.333 35
527.34 1.320 1000
504.91 1.264 31
497.59 1.246 48
492.55 1.233 32
490.26 1.227 38
485.23 1.215 37
382.39 0.957 281
375.21 0.939 556
367.89 0.921 229
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| 1H NMR |
89.56 MHz |
| C8 H13 N O2
|
0.038 g : 0.5 ml CDCl3
|
| alpha-methyl-alpha-propylsuccinimide
|
|
Assign. Shift(ppm)
A 9.
B *1 2.645
C *1 2.496
D 1.56
E 1.315
F 1.26
G 0.94
J(B,C)=18.4HZ.
|
Hz ppm Int.
252.31 2.818 65
233.94 2.613 332
226.69 2.532 376
208.31 2.326 77
150.00 1.675 38
147.69 1.650 31
146.88 1.641 36
144.06 1.609 65
140.13 1.565 61
138.31 1.545 61
136.13 1.520 67
130.94 1.463 53
129.69 1.449 43
126.31 1.411 32
125.13 1.398 31
122.69 1.370 60
117.88 1.317 1000
114.00 1.273 52
113.00 1.262 37
109.63 1.225 35
104.56 1.168 39
89.88 1.004 149
88.19 0.985 81
83.38 0.931 136
82.63 0.923 140
78.38 0.876 37
76.69 0.857 51