4-(DIMETHYLAMINO)BENZONITRILE(1197-19-9) Raman
Product Name4-(DIMETHYLAMINO)BENZONITRILE
CAS1197-19-9
Molecular FormulaC9H10N2
Molecular Weight146.19
InChIInChI=1S/C9H10N2/c1-11(2)9-5-3-8(7-10)4-6-9/h3-6H,1-2H3
InChIKey JYMNQRQQBJIMCV-UHFFFAOYSA-N
SmilesC(#N)C1=CC=C(N(C)C)C=C1
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MassMS-NW-6497 p-(dimethylamino)benzonitrile C9H10N2 (Mass of molecular ion: 146)
Source Temperature: 260 °C Sample Temperature: 190 °C Reservoir, 75 eV
15.0 3.4 27.0 1.3 28.0 2.1 38.0 1.1 39.0 2.0 42.0 5.8 43.0 1.2 44.0 1.9 50.0 2.8 51.0 3.6 52.0 1.6 62.0 1.0 63.0 2.1 64.0 2.3 65.0 1.7 72.5 2.1 73.0 2.8 74.0 1.0 75.0 4.1 76.0 3.7 77.0 3.0 89.0 1.2 90.0 1.5 91.0 1.3 102.0 11.5 103.0 2.4 104.0 2.6 116.0 2.5 117.0 1.8 118.0 1.5 119.0 1.0 128.0 1.7 129.0 10.4 130.0 9.4 131.0 2.6 143.0 2.7 144.0 1.2 145.0 100.0 146.0 77.0 147.0 7.7
90 MHz in CDCl3
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1H NMR 89.56 MHz C9 H10 N2 0.041 g : 0.5 ml CDCl3 p-(dimethylamino)benzonitrile 
Assign. Shift(ppm)
A 7.434 B 6.626 C 3.023
Hz ppm Int.671.13 7.494 109 668.94 7.470 34 664.13 7.416 34 661.94 7.392 143 597.69 6.674 100 595.50 6.650 30 590.69 6.596 23 588.56 6.572 80 270.75 3.024 1000
in CDCl3
KBr disc
nujol mull
