Product Name4-Amino-4'-chlorodiphenyl ether
CAS101-79-1
Molecular FormulaC12H10ClNO
Molecular Weight219.67
InChIInChI=1S/C12H10ClNO/c13-9-1-5-11(6-2-9)15-12-7-3-10(14)4-8-12/h1-8H,14H2
InChIKey YTISFYMPVILQRL-UHFFFAOYSA-N
SmilesC1(N)=CC=C(OC2=CC=C(Cl)C=C2)C=C1
Mass
MS-NW-7928 p-(p-chlorophenoxy)aniline C12H10ClNO (Mass of molecular ion: 219)
Source Temperature: 150 °C Sample Temperature: 90 °C Direct, 75 eV
18.0 1.0 27.0 1.5 28.0 2.5 38.0 1.4 39.0 5.8 41.0 1.4 50.0 2.8 51.0 2.5 52.0 3.3 53.0 5.2 54.0 1.7 62.0 1.0 63.0 3.5 64.0 2.3 65.0 9.6 66.0 1.5 74.0 1.3 75.0 5.4 76.0 1.2 77.0 1.3 80.0 13.2 81.0 1.1 92.0 2.0 108.0 78.6 109.0 6.2 111.0 3.0 113.0 1.0 127.0 1.8 128.0 2.2 139.0 1.0 154.0 1.5 156.0 6.1 183.0 1.4 184.0 1.0 190.0 3.3 192.0 1.2 218.0 1.8 219.0 100.0 220.0 14.5 221.0 32.8 222.0 4.5
400 MHz in DMSO-d6
1H NMR | 399.65 MHz |
C12 H10 Cl N O | 0.036 g : 0.5 ml DMSO-d6 |
p-(p-chlorophenoxy)aniline |
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Assign. Shift(ppm) |
Hz ppm Int.
2938.84 7.354 111 2935.30 7.345 875 2933.23 7.340 303 2928.71 7.329 319 2926.51 7.323 994 2922.97 7.314 103 2753.42 6.890 131 2750.00 6.882 958 2747.80 6.876 313 2743.16 6.864 305 2741.09 6.859 895 2737.43 6.850 92 2718.63 6.803 104 2715.21 6.794 786 2713.13 6.789 278 2708.74 6.778 317 2706.54 6.773 1000 2703.13 6.764 111 2652.22 6.637 138 2648.80 6.628 992 2646.73 6.623 303 2642.33 6.612 278 2640.14 6.607 778 2636.72 6.598 78 2013.18 5.038 676
in DMSO-d6
in CDCl3
KBr disc
nujol mull
4-Amino-4'-chlorodiphenyl ether(101-79-1) IR1 Atlas of Related Products
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