Product Name4-Methyl-3-nitroaniline
CAS119-32-4
Molecular FormulaC7H8N2O2
Molecular Weight152.15
InChIInChI=1S/C7H8N2O2/c1-5-2-3-6(8)4-7(5)9(10)11/h2-4H,8H2,1H3
InChIKey GDIIPKWHAQGCJF-UHFFFAOYSA-N
SmilesC1(N)=CC=C(C)C([N+]([O-])=O)=C1

Mass
MS-NW-1713 3-nitro-p-toluidine C7H8N2O2 (Mass of molecular ion: 152)
Source Temperature: 180 °C Sample Temperature: 120 °C Direct, 75 eV
18.0 2.3
26.0 1.7
27.0 8.7
28.0 18.0
29.0 1.3
30.0 6.2
37.0 1.7
38.0 4.2
39.0 17.8
40.0 3.5
41.0 8.8
42.0 5.5
49.0 1.1
50.0 9.8
51.0 24.5
52.0 21.8
53.0 17.9
54.0 11.0
55.0 1.1
61.0 1.6
62.0 4.2
63.0 10.1
64.0 4.0
65.0 10.7
66.0 8.9
67.0 7.2
74.0 2.1
75.0 2.6
76.0 4.2
77.0 84.5
78.0 29.8
79.0 54.5
80.0 34.9
81.0 2.8
89.0 5.6
90.0 2.4
91.0 3.8
92.0 4.0
93.0 5.8
94.0 4.9
95.0 1.1
102.0 1.2
104.0 38.9
105.0 56.2
106.0 64.6
107.0 88.4
108.0 8.8
118.0 1.8
120.0 1.0
122.0 2.0
135.0 77.6
136.0 7.0
152.0 100.0
153.0 8.7
400 MHz in CDCl3

| 1H NMR | 399.65 MHz |
| C7 H8 N2 O2 | 0.038 g : 0.5 ml CDCl3 |
| 3-nitro-p-toluidine | |
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Assign. Shift(ppm) |
Hz ppm Int.
2909.30 7.280 242
2906.86 7.274 250
2831.91 7.086 149
2823.73 7.066 171
2726.68 6.823 134
2724.12 6.817 128
2718.38 6.802 115
2715.94 6.796 108
1552.86 3.886 101
978.88 2.450 1000
in CDCl3

CCl4 solution

KBr disc

nujol mull

4-Methyl-3-nitroaniline(119-32-4) 1H NMR Atlas of Related Products
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