4-Aminobenzylamine(4403-71-8) MS
Product Name4-Aminobenzylamine
CAS4403-71-8
Molecular FormulaC7H10N2
Molecular Weight122.17
InChIInChI=1S/C7H10N2/c8-5-6-1-3-7(9)4-2-6/h1-4H,5,8-9H2
InChIKey BFWYZZPDZZGSLJ-UHFFFAOYSA-N
SmilesC1(CN)=CC=C(N)C=C1
-
MassMS-KW-0557 4-aminobenzylamine C7H10N2 (Mass of molecular ion: 122)
Source Temperature: 240 °C Sample Temperature: 150 °C Reservoir, 75 eV
27.0 2.1 28.0 5.6 29.0 1.6 30.0 10.4 37.0 1.1 38.0 2.5 39.0 9.6 40.0 2.2 41.0 5.4 42.0 2.3 43.0 1.3 44.0 24.5 45.0 1.0 50.0 3.6 51.0 8.1 52.0 7.7 53.0 4.1 54.0 3.7 56.0 1.7 59.5 1.4 60.0 3.3 60.5 4.0 61.0 4.6 62.0 1.9 63.0 4.3 64.0 2.3 65.0 13.1 66.0 9.3 67.0 4.6 74.0 1.0 75.0 1.2 76.0 2.0 77.0 33.5 78.0 14.1 79.0 8.6 80.0 2.6 82.0 1.5 89.0 1.1 91.0 1.9 92.0 6.5 93.0 20.5 94.0 54.5 95.0 4.3 104.0 13.1 105.0 18.0 106.0 82.8 107.0 11.6 119.0 6.3 120.0 4.3 121.0 100.0 122.0 78.6 123.0 6.1
400 MHz in CDCl3
-
1H NMR 399.65 MHz C7H10N2 0.05 ml : 0.5 ml CDCl3 4-aminobenzylamine 
Assign. Shift(ppm)
A 7.038 B 6.591 C 3.678
Hz ppm Int.2820.32 7.055 101 2819.71 7.054 94 2817.75 7.049 564 2817.14 7.047 442 2815.56 7.043 211 2811.28 7.033 224 2809.70 7.029 474 2809.21 7.027 582 2806.65 7.021 91 2641.24 6.607 124 2638.68 6.601 722 2636.60 6.596 255 2632.21 6.585 249 2630.13 6.579 635 2627.57 6.573 94 2621.83 6.559 15 1839.85 4.603 7 1566.41 3.919 4 1536.50 3.844 14 1470.22 3.678 1000 1401.98 3.507 14 1332.28 3.333 6 656.62 1.643 17
in CDCl3
Liquid film
