3,3'-DICHLOROPIVALIC ACID(67329-11-7) 1H NMR
Molecular FormulaC5H8Cl2O2
Molecular Weight171.02
InChIInChI=1S/C5H8Cl2O2/c1-5(2-6,3-7)4(8)9/h2-3H2,1H3,(H,8,9)
InChIKey DDSPBKFTRPWDLI-UHFFFAOYSA-N
SmilesC(O)(=O)C(CCl)(C)CCl
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![](https://www.chemicalbook.com/Spectrum/67329-11-7_MS_1.jpg)
Mass
MS-NW-6509
2,2-bis(chloromethyl)propionic acid
C5H8Cl2O2 (Mass of molecular ion: 170)
Source Temperature: 250 °C
Sample Temperature: 190 °C
Reservoir, 75 eV
14.0 1.1
15.0 3.5
18.0 1.8
26.0 5.4
27.0 38.5
28.0 5.3
29.0 30.9
31.0 2.8
35.0 3.1
36.0 23.3
37.0 4.7
38.0 8.4
39.0 68.1
40.0 8.6
41.0 82.5
42.0 5.3
43.0 10.4
44.0 13.1
45.0 21.2
47.0 1.7
48.0 1.7
49.0 23.6
50.0 4.9
51.0 8.4
52.0 3.1
53.0 61.5
54.0 22.6
55.0 74.8
56.0 3.9
57.0 10.6
58.0 1.0
60.0 1.0
61.0 3.8
62.0 4.3
63.0 40.7
64.0 2.4
65.0 12.7
68.0 1.0
69.0 31.7
70.0 2.6
71.0 5.5
73.0 3.3
74.0 1.2
75.0 14.6
76.0 1.3
77.0 6.7
81.0 4.2
83.0 6.1
85.0 16.3
86.0 2.9
87.0 1.6
88.0 2.5
89.0 61.6
90.0 67.5
91.0 22.4
92.0 22.9
93.0 2.5
97.0 1.6
98.0 13.1
99.0 54.8
100.0 3.6
103.0 9.1
104.0 7.0
105.0 3.6
106.0 2.4
116.0 1.1
119.0 2.1
121.0 100.0
122.0 4.7
123.0 31.5
124.0 5.1
125.0 19.9
126.0 3.3
127.0 12.4
128.0 1.0
129.0 2.0
134.0 10.6
135.0 70.0
136.0 7.2
137.0 22.9
138.0 1.4
155.0 1.3