Product Name1,8-Diaminooctane
CAS373-44-4
Molecular FormulaC8H20N2
Molecular Weight144.26
InChIInChI=1S/C8H20N2/c9-7-5-3-1-2-4-6-8-10/h1-10H2
InChIKey PWGJDPKCLMLPJW-UHFFFAOYSA-N
SmilesC(N)CCCCCCCN

Mass
MS-NW-4671 octamethylenediamine C8H20N2 (Mass of molecular ion: 144)
Source Temperature: 240 °C Sample Temperature: 180 °C Reservoir, 75 eV
18.0 10.7
27.0 2.0
28.0 3.0
29.0 2.0
30.0 100.0
31.0 3.3
39.0 1.8
41.0 5.6
42.0 3.5
43.0 3.1
44.0 10.3
45.0 6.0
54.0 1.1
55.0 6.9
56.0 10.3
57.0 1.3
58.0 1.0
59.0 3.1
67.0 1.1
69.0 3.3
70.0 4.7
72.0 5.2
73.0 1.2
84.0 1.2
86.0 6.0
87.0 1.4
98.0 1.3
100.0 3.5
114.0 1.8
115.0 8.3
128.0 5.8
90 MHz in CDCl3

| 1H NMR | 89.56 MHz |
| C8 H20 N2 | 0.049 g : 0.5 ml CDCl3 |
| octamethylenediamine | |
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Assign. Shift(ppm) |
Hz ppm Int.
246.38 2.752 72
246.00 2.747 71
244.56 2.731 67
244.19 2.727 66
243.69 2.721 65
243.06 2.714 64
239.63 2.676 258
233.06 2.603 122
135.00 1.508 45
134.38 1.501 46
133.81 1.495 46
132.38 1.479 52
131.56 1.469 56
130.13 1.453 64
129.75 1.449 67
127.56 1.425 89
126.75 1.416 92
118.44 1.323 689
111.38 1.244 53
97.50 1.089 1000
in CDCl3

KBr disc

nujol mull


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