Product Name2-Chloro-4-nitrotoluene
CAS121-86-8
Molecular FormulaC7H6ClNO2
Molecular Weight171.58
InChIInChI=1S/C7H6ClNO2/c1-5-2-3-6(9(10)11)4-7(5)8/h2-4H,1H3
InChIKey LLYXJBROWQDVMI-UHFFFAOYSA-N
SmilesC1(C)=CC=C([N+]([O-])=O)C=C1Cl

Mass
MS-NW-1829 2-chloro-4-nitrotoluene C7H6ClNO2 (Mass of molecular ion: 171)
Source Temperature: 250 °C Sample Temperature: 180 °C Reservoir, 75 eV
18.0 2.4
26.0 1.3
27.0 3.1
28.0 2.5
30.0 20.8
37.0 3.2
38.0 5.6
39.0 26.0
40.0 2.2
41.0 1.4
43.0 2.1
46.0 1.0
49.0 2.4
50.0 10.9
51.0 15.9
52.0 2.9
53.0 1.0
61.0 5.1
62.0 13.8
63.0 45.0
64.0 7.0
65.0 6.5
73.0 10.4
74.0 4.3
75.0 7.6
76.0 1.6
77.0 38.4
78.0 6.7
84.0 1.6
85.0 3.0
86.0 4.2
87.0 4.5
88.0 1.7
89.0 80.1
90.0 22.8
91.0 2.3
97.0 2.0
99.0 27.8
100.0 1.6
101.0 8.7
105.0 10.8
106.0 1.7
113.0 14.7
114.0 1.2
115.0 4.5
123.0 1.8
124.0 1.7
125.0 99.5
126.0 8.2
127.0 31.5
128.0 2.7
141.0 24.2
142.0 2.2
143.0 8.0
155.0 2.1
171.0 100.0
172.0 8.1
173.0 32.0
174.0 2.7

in CDCl3

CCl4 solution

KBr disc

liquid film

nujol mull

4880 A,200 M,powder

2-Chloro-4-nitrotoluene(121-86-8) IR1 Atlas of Related Products
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