Product Name2-Amino-4-nitro anisidine
CAS99-59-2
Molecular FormulaC7H8N2O3
Molecular Weight168.15
InChIInChI=1S/C7H8N2O3/c1-12-7-3-2-5(9(10)11)4-6(7)8/h2-4H,8H2,1H3
InChIKey NIPDVSLAMPAWTP-UHFFFAOYSA-N
SmilesC1(N)=CC([N+]([O-])=O)=CC=C1OC
Mass
MS-NW-8110 5-nitro-o-anisidine C7H8N2O3 (Mass of molecular ion: 168)
Source Temperature: 150 °C Sample Temperature: 80 °C Direct, 75 eV
17.0 1.4 18.0 7.1 28.0 7.4 30.0 6.5 38.0 1.7 39.0 3.4 40.0 1.0 41.0 3.9 42.0 1.4 44.0 1.1 50.0 2.9 51.0 8.8 52.0 17.1 53.0 5.1 54.0 1.8 62.0 1.9 63.0 3.8 64.0 2.2 65.0 10.9 66.0 2.2 67.0 8.6 68.0 1.8 76.0 1.3 77.0 9.7 78.0 7.4 79.0 16.2 80.0 5.2 82.0 1.3 90.0 3.0 91.0 2.5 92.0 8.6 93.0 4.8 94.0 3.5 95.0 14.6 96.0 1.1 106.0 1.3 107.0 8.8 110.0 4.4 121.0 1.9 122.0 20.1 123.0 4.5 138.0 3.6 150.0 1.2 152.0 1.1 153.0 24.7 154.0 1.8 168.0 100.0 169.0 8.6
90 MHz in CDCl3
1H NMR | 89.56 MHz |
C7 H8 N2 O3 | 0.044 g : 0.5 ml CDCl3 |
5-nitro-o-anisidine |
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Assign. Shift(ppm) |
Hz ppm Int.
690.94 7.715 81 688.25 7.685 122 682.31 7.619 73 679.56 7.588 177 676.38 7.553 208 676.06 7.549 219 673.69 7.523 133 611.50 6.828 147 602.81 6.731 118 364.56 4.071 76 352.88 3.941 1000
in CDCl3
KBr disc
nujol mull
2-Amino-4-nitro anisidine(99-59-2) 13C NMR Atlas of Related Products
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