油胺(112-90-3)核磁圖(13CNMR)
InChI:InChI=1S/C18H37N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h9-10H,2-8,11-19H2,1H3/b10-9-
InChIKey: QGLWBTPVKHMVHM-KTKRTIGZSA-N
Smiles:C(N)CCCCCCC/C=C\CCCCCCCC
-
Mass
MS-NW-8361
cis-9-octadecenylamine
C18H37N (Mass of molecular ion: 267)
Source Temperature: 260 °C
Sample Temperature: 130 °C
Reservoir, 75 eV
17.0 3.6
18.0 24.5
27.0 2.2
28.0 7.1
29.0 5.1
30.0 100.0
31.0 2.2
32.0 1.2
39.0 1.8
41.0 11.8
42.0 2.5
43.0 11.5
44.0 24.0
45.0 8.9
47.0 1.9
53.0 1.0
54.0 2.5
55.0 11.5
56.0 8.5
57.0 4.5
58.0 1.1
59.0 2.8
67.0 4.9
68.0 1.9
69.0 5.9
70.0 2.9
71.0 1.5
72.0 2.7
73.0 2.6
75.0 12.3
77.0 1.9
81.0 4.1
82.0 3.6
83.0 3.8
84.0 1.6
86.0 4.4
87.0 1.1
95.0 3.0
96.0 2.8
97.0 2.5
98.0 1.1
100.0 11.9
101.0 1.2
109.0 1.5
110.0 1.2
111.0 1.0
112.0 1.3
114.0 3.3
140.0 1.7
142.0 1.0
147.0 1.1
154.0 5.5
168.0 3.2
182.0 2.6
196.0 1.1
267.0 2.1
90 MHz in CDCl3
400 MHz in CDCl3
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| 1H NMR |
89.56 MHz |
| C18 H37 N
|
0.04 ml : 0.5 ml CDCl3
|
| cis-9-octadecenylamine
|
 |
Assign. Shift(ppm)
A 5.45 to 5.26
B 2.67
C 1.99
D 1.50 to 1.17
E 1.13
F 0.88
400MHZ : HSP-40-522
|
Hz ppm Int.
483.06 5.394 51
481.88 5.381 39
479.63 5.356 51
478.50 5.343 90
477.38 5.331 46
474.13 5.294 43
473.13 5.283 32
241.50 2.697 40
239.81 2.678 55
237.75 2.655 37
235.50 2.630 30
235.19 2.627 30
233.63 2.609 34
233.25 2.605 34
186.06 2.078 30
183.25 2.047 58
182.75 2.041 60
182.38 2.037 59
181.38 2.026 57
180.56 2.017 56
180.19 2.012 56
178.06 1.989 74
177.50 1.982 76
177.19 1.979 74
174.06 1.944 53
173.69 1.940 50
173.56 1.938 50
173.00 1.932 49
172.00 1.921 45
171.56 1.916 43
171.19 1.912 42
170.56 1.905 40
169.88 1.897 32
169.25 1.890 31
133.88 1.495 31
132.88 1.484 37
132.31 1.478 41
131.69 1.471 42
128.63 1.437 74
128.31 1.433 75
127.63 1.426 73
126.75 1.416 79
126.06 1.408 82
112.88 1.261 1000
100.63 1.124 116
89.44 0.999 41
88.75 0.991 42
84.25 0.941 79
83.81 0.936 79
83.06 0.928 75
81.94 0.915 72
81.56 0.911 73
78.81 0.880 168
74.88 0.837 49
74.06 0.827 50
72.50 0.810 54
72.06 0.805 50
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| 1H NMR |
399.65 MHz |
| C18 H37 N
|
0.04 ml : 0.5 ml CDCl3
|
| cis-9-octadecenylamine
|
|
Assign. Shift(ppm)
A 5.39 to 5.330
B 2.677
C 2.03 to 1.940
D 1.43
E 1.38 to 1.210
F 1.17
G 0.881
90MHZ : HSP-06-001
|
Hz ppm Int.
2154.66 5.392 39
2154.30 5.391 38
2152.22 5.386 48
2151.00 5.383 62
2149.54 5.379 42
2147.46 5.374 46
2145.87 5.370 34
2142.82 5.362 80
2142.46 5.361 81
2141.48 5.359 80
2137.33 5.349 214
2133.30 5.338 72
2131.71 5.334 89
1076.90 2.695 108
1069.95 2.678 185
1062.99 2.660 109
813.48 2.036 74
812.99 2.035 73
812.38 2.033 72
807.25 2.020 172
801.51 2.006 159
794.68 1.989 92
790.65 1.979 44
787.23 1.970 58
784.55 1.964 50
783.81 1.962 49
782.96 1.960 49
782.59 1.959 50
585.69 1.466 31
578.25 1.447 81
576.66 1.443 76
575.93 1.442 76
571.90 1.432 118
567.50 1.420 80
564.94 1.414 96
559.69 1.401 46
557.98 1.397 49
554.93 1.389 34
553.10 1.384 34
552.49 1.383 34
552.12 1.382 35
551.76 1.381 35
551.03 1.379 37
550.42 1.378 38
516.72 1.293 811
515.01 1.289 851
506.23 1.267 843
501.95 1.256 1000
486.94 1.219 41
467.65 1.171 70
358.52 0.898 190
352.29 0.882 481
344.97 0.864 204