4-Benzyloxyaniline hydrochloride(51388-20-6) IR2
Product Name4-Benzyloxyaniline hydrochloride
CAS51388-20-6
Molecular FormulaC13H14ClNO
Molecular Weight235.71
InChIInChI=1S/C13H13NO.ClH/c14-12-6-8-13(9-7-12)15-10-11-4-2-1-3-5-11;/h1-9H,10,14H2;1H
InChIKey KQBDLOVXZHOAJI-UHFFFAOYSA-N
SmilesC1(=CC=C(N)C=C1)OCC1=CC=CC=C1.Cl
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MassMS-NW-6863 p-(benzyloxy)aniline hydrochloride C13H13NO HCl (Mass of molecular ion: 199)
Source Temperature: 160 °C Sample Temperature: 120 °C Direct, 75 eV
27.0 1.0 28.0 1.2 35.0 1.0 36.0 9.9 38.0 3.3 39.0 3.1 41.0 1.1 51.0 1.7 52.0 2.0 53.0 3.6 54.0 1.0 63.0 1.5 65.0 7.1 80.0 8.7 89.0 1.1 91.0 31.4 92.0 2.7 108.0 100.0 109.0 7.5 199.0 34.8 200.0 5.4
400 MHz in DMSO-d6
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1H NMR 399.65 MHz C13 H13 N O 0.036 g : 0.5 ml DMSO-d6 p-(benzyloxy)aniline hydrochloride 
Assign. Shift(ppm)
A 10.4 B 7.453 C 7.40 D 7.37 E 7.33 F 7.121 G 5.128
Hz ppm Int.4157.51 10.403 129 2983.60 7.466 206 2982.13 7.462 281 2975.17 7.445 485 2968.03 7.427 31 2963.82 7.417 204 2962.90 7.414 286 2960.89 7.409 113 2955.76 7.396 528 2954.29 7.393 249 2952.09 7.387 117 2948.61 7.378 766 2946.42 7.373 252 2941.84 7.362 227 2939.64 7.356 755 2938.17 7.352 296 2936.53 7.348 192 2933.41 7.340 95 2930.85 7.334 227 2928.10 7.327 62 2924.99 7.319 50 2923.70 7.316 70 2853.73 7.141 80 2850.44 7.133 621 2848.24 7.127 204 2843.48 7.115 180 2841.46 7.110 518 2837.98 7.102 61 2049.45 5.129 1000
KBr disc
nujol mull
