Product Name1,2-DICHLOROOCTANE
CAS21948-46-9
Molecular FormulaC8H16Cl2
Molecular Weight183.12
InChI
InChIKey
Smiles

Mass
MS-NW-8430 1,2-dichlorooctane C8H16Cl2 (Mass of molecular ion: 182)
Source Temperature: 260 °C Sample Temperature: 140 °C Reservoir, 75 eV
26.0 1.3
27.0 26.4
28.0 4.8
29.0 34.9
36.0 2.8
38.0 1.3
39.0 22.1
40.0 3.9
41.0 82.2
42.0 35.1
43.0 100.0
44.0 3.4
49.0 4.4
51.0 3.3
53.0 11.8
54.0 18.6
55.0 81.2
56.0 41.7
57.0 37.2
58.0 1.6
59.0 1.3
61.0 3.1
62.0 3.0
63.0 6.8
64.0 1.1
65.0 3.5
66.0 2.1
67.0 26.7
68.0 28.6
69.0 30.4
70.0 63.2
71.0 9.5
75.0 12.0
76.0 3.5
77.0 7.3
78.0 1.4
79.0 3.5
80.0 1.1
81.0 37.1
82.0 12.7
83.0 12.4
84.0 6.9
85.0 6.5
89.0 9.4
90.0 3.0
91.0 11.4
92.0 1.3
93.0 2.9
95.0 7.5
97.0 18.1
98.0 1.4
103.0 29.9
104.0 34.9
105.0 12.5
106.0 11.3
107.0 1.2
109.0 2.2
110.0 3.4
111.0 3.0
117.0 8.0
118.0 3.8
119.0 3.2
120.0 1.2
125.0 4.4
127.0 2.7
139.0 21.6
140.0 1.3
141.0 14.1
143.0 2.5
153.0 1.8
155.0 1.1
400 MHz in CDCl3

| 1H NMR | 399.65 MHz |
| C8 H16 Cl2 | 0.05 ml : 0.5 ml CDCl3 |
| 1,2-dichlorooctane | |
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Assign. Shift(ppm) |
Hz ppm Int.
1625.85 4.069 64
1622.07 4.059 72
1620.73 4.056 78
1618.41 4.050 83
1616.94 4.046 137
1614.62 4.041 92
1613.28 4.037 139
1611.82 4.034 91
1609.50 4.028 150
1607.91 4.024 84
1605.71 4.018 80
1604.37 4.015 85
1600.59 4.005 76
1512.21 3.784 272
1506.96 3.771 260
1500.85 3.756 453
1495.73 3.743 403
1469.36 3.677 465
1461.91 3.658 436
1458.01 3.649 298
1450.56 3.630 263
811.16 2.030 53
807.37 2.021 58
805.79 2.017 64
801.88 2.007 68
801.15 2.005 85
797.24 1.995 136
795.41 1.991 85
793.33 1.986 85
791.50 1.981 145
786.99 1.970 115
783.08 1.960 95
781.13 1.955 95
777.34 1.946 91
703.00 1.760 61
698.49 1.748 89
693.36 1.735 97
689.45 1.726 107
688.48 1.723 130
684.33 1.713 126
679.44 1.701 130
675.42 1.691 72
674.19 1.687 82
670.04 1.677 57
665.28 1.665 74
573.36 1.435 76
568.73 1.424 73
563.11 1.410 75
554.93 1.389 75
528.56 1.323 308
527.47 1.320 323
525.76 1.316 367
521.48 1.305 632
516.60 1.293 358
364.38 0.912 298
361.94 0.906 214
361.08 0.904 232
357.54 0.895 1000
354.86 0.888 168
350.59 0.878 296
in CDCl3

liquid film

1,2-DICHLOROOCTANE(21948-46-9) 1H NMR Atlas of Related Products
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