Product Name3,4-Dimethylaniline
CAS95-64-7
Molecular FormulaC8H11N
Molecular Weight121.18
InChIInChI=1S/C8H11N/c1-6-3-4-8(9)5-7(6)2/h3-5H,9H2,1-2H3
InChIKey DOLQYFPDPKPQSS-UHFFFAOYSA-N
SmilesC1(N)=CC=C(C)C(C)=C1
Mass
MS-NW-1683 3,4-xylidine C8H11N (Mass of molecular ion: 121)
Source Temperature: 240 °C Sample Temperature: 180 °C Reservoir, 75 eV
27.0 3.1 28.0 3.8 30.0 1.0 38.0 1.2 39.0 6.0 41.0 3.1 42.0 2.7 50.0 1.9 51.0 4.8 52.0 3.3 53.0 4.8 54.0 1.9 58.5 2.5 59.5 2.3 60.5 1.7 63.0 2.0 65.0 4.0 66.0 1.7 77.0 12.2 78.0 3.6 79.0 3.7 80.0 2.6 91.0 7.5 92.0 1.8 93.0 4.6 94.0 1.7 103.0 2.7 104.0 2.4 105.0 1.3 106.0 55.3 107.0 4.6 117.0 1.0 118.0 3.1 119.0 2.8 120.0 66.9 121.0 100.0 122.0 8.9
90 MHz in CDCl3
1H NMR | 89.56 MHz |
C8 H11 N | 0.041 g : 0.5 ml CDCl3 |
3,4-xylidine |
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Assign. Shift(ppm) |
Hz ppm Int.
621.75 6.943 97 614.19 6.858 137 581.25 6.491 352 578.56 6.461 60 573.56 6.405 96 571.13 6.378 60 306.56 3.423 652 194.38 2.171 887 191.81 2.142 1000
in CDCl3
CCl4 solution
KBr disc
nujol mull
3,4-Dimethylaniline(95-64-7) IR1 Atlas of Related Products