己二酸二酰肼(1071-93-8)Raman光譜
InChI:InChI=1S/C6H14N4O2/c7-9-5(11)3-1-2-4-6(12)10-8/h1-4,7-8H2,(H,9,11)(H,10,12)
InChIKey: IBVAQQYNSHJXBV-UHFFFAOYSA-N
Smiles:C(=O)(NN)CCCCC(=O)NN
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Mass
MS-NW-0248
adipohydrazide
C6H14N4O2 (Mass of molecular ion: 174)
Source Temperature: 210 °C
Sample Temperature: 0 °C
Direct, 75 eV
18.0 6.1
27.0 7.0
28.0 5.4
29.0 7.6
30.0 1.5
31.0 21.0
32.0 21.1
33.0 13.6
39.0 5.8
40.0 1.0
41.0 9.2
42.0 2.1
43.0 3.6
44.0 2.0
53.0 2.6
54.0 1.4
55.0 24.4
56.0 2.5
57.0 4.2
59.0 21.9
67.0 1.1
69.0 1.6
73.0 3.3
74.0 3.2
80.0 3.0
82.0 4.4
83.0 7.8
84.0 1.5
87.0 2.1
97.0 4.8
98.0 1.2
101.0 3.4
108.0 3.5
111.0 28.1
112.0 2.1
114.0 2.0
115.0 20.6
116.0 1.4
125.0 3.5
142.0 1.4
143.0 100.0
144.0 6.6
174.0 2.3
400 MHz in DMSO-d6
90 MHz in DMSO-d6
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| 1H NMR |
399.65 MHz |
| C6 H14 N4 O2
|
saturated in DMSO-d6
|
| adipohydrazide
|
 |
Assign. Shift(ppm)
A 8.93
B 4.15
C 1.991
D 1.443
|
Hz ppm Int.
3569.95 8.933 562
1658.94 4.151 1000
801.85 2.007 432
801.09 2.005 432
795.75 1.992 896
789.79 1.977 447
577.09 1.444 914
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| 1H NMR |
89.56 MHz |
| C6 H14 N4 O2
|
0.039 g : 0.5 ml DMSO-d6
|
| adipohydrazide
|
|
Assign. Shift(ppm)
A 8.89
B 4.14
C 2.00
D 1.46
|
Hz ppm Int.
796.56 8.895 529
370.50 4.137 1000
185.56 2.072 271
185.13 2.068 270
184.31 2.058 266
179.38 2.003 831
173.38 1.936 429
170.25 1.901 150
169.88 1.897 146
136.69 1.527 371
133.19 1.488 483
130.13 1.453 813
127.06 1.419 423
126.81 1.416 423
124.06 1.386 247
123.75 1.382 248
120.50 1.346 89