tert-Butyl Hypochlorite(507-40-4) Raman
Molecular FormulaC4H9ClO
Molecular Weight108.57
InChIInChI=1S/C4H9ClO/c1-4(2,3)6-5/h1-3H3
InChIKey IXZDIALLLMRYOU-UHFFFAOYSA-N
SmilesClOC(C)(C)C
-

Mass
MS-NW-4351
tert-butyl hypochlorite
C4H9ClO (Mass of molecular ion: 108)
Source Temperature: 220 °C
Sample Temperature: 180 °C
Reservoir, 75 eV
14.0 1.1
15.0 7.3
18.0 1.4
26.0 2.2
27.0 9.5
29.0 12.3
31.0 23.1
36.0 1.0
37.0 1.4
38.0 1.8
39.0 8.1
40.0 1.1
41.0 20.0
42.0 3.9
43.0 50.0
44.0 1.6
47.0 1.8
48.0 1.0
49.0 4.8
50.0 6.3
51.0 1.6
52.0 2.0
53.0 1.1
55.0 3.8
56.0 2.4
57.0 11.6
58.0 4.0
59.0 100.0
60.0 3.7
62.0 1.0
63.0 2.1
73.0 1.8
77.0 2.6
83.0 2.3
84.0 1.4
85.0 1.6
91.0 1.4
93.0 14.4
95.0 4.4
117.0 1.6
119.0 1.3
125.0 1.0
127.0 1.5
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1H NMR |
300 MHz |
C4 H9 Cl O
|
0.05 ml : 0.5 ml CDCl3
|
tert-butyl hypochlorite
|
 |
Parameter ppm Hz
D(A) 1.333
|
Hz ppm Int.
399.90 1.333 1000