Product Name2-Chlorobutane
CAS78-86-4
Molecular FormulaC4H9Cl
Molecular Weight92.57
InChIInChI=1S/C4H9Cl/c1-3-4(2)5/h4H,3H2,1-2H3
InChIKey BSPCSKHALVHRSR-UHFFFAOYSA-N
SmilesCC(Cl)CC

Mass
MS-NW-0940 2-chlorobutane C4H9Cl (Mass of molecular ion: 92)
Source Temperature: 280 °C Sample Temperature: 150 °C Reservoir, 75 eV
15.0 1.4
18.0 1.3
26.0 5.4
27.0 37.1
28.0 12.6
29.0 39.3
30.0 1.0
36.0 2.4
37.0 1.4
38.0 2.3
39.0 17.3
40.0 2.6
41.0 64.1
42.0 3.6
43.0 1.7
49.0 2.8
50.0 2.5
51.0 2.2
53.0 2.4
55.0 9.3
56.0 92.6
57.0 100.0
58.0 4.5
61.0 1.1
62.0 13.2
63.0 44.1
64.0 5.1
65.0 13.9
76.0 1.0
77.0 5.5
79.0 1.7
90 MHz in CDCl3

| 1H NMR | 89.56 MHz |
| C4 H9 Cl | 0.04 ml : 0.5 ml CDCl3 |
| 2-chlorobutane | |
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Assign. Shift(ppm) |
Hz ppm Int.
365.88 4.086 55
359.44 4.014 96
353.31 3.945 106
346.75 3.872 64
171.44 1.915 35
170.25 1.901 33
165.44 1.848 43
164.69 1.839 52
163.38 1.825 136
158.88 1.775 47
157.38 1.758 149
156.06 1.743 196
151.44 1.691 56
149.63 1.671 182
148.63 1.660 73
145.38 1.624 40
142.81 1.595 92
137.69 1.538 1000
135.50 1.513 49
131.19 1.465 938
129.13 1.442 45
98.06 1.095 289
91.13 1.018 510
83.56 0.934 182
82.63 0.923 106
in CDCl3

CCl4 solution

liquid film


2-Chlorobutane(78-86-4) Raman Atlas of Related Products
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