N-芐叉苯胺(538-51-2)紅外圖譜(IR1)
InChI:InChI=1S/C13H11N/c1-3-7-12(8-4-1)11-14-13-9-5-2-6-10-13/h1-11H
InChIKey: UVEWQKMPXAHFST-UHFFFAOYSA-N
Smiles:C1(N=CC2=CC=CC=C2)=CC=CC=C1
-
Mass
MS-NW-5563
N-benzylideneaniline
C13H11N (Mass of molecular ion: 181)
Source Temperature: 250 °C
Sample Temperature: 190 °C
Reservoir, 75 eV
27.0 1.7
28.0 1.3
38.0 1.1
39.0 3.8
50.0 4.4
51.0 20.3
52.0 3.0
62.0 1.1
63.0 3.2
64.0 1.8
74.0 1.3
75.0 1.4
76.0 4.9
77.0 58.6
77.5 1.1
78.0 13.8
89.0 4.0
89.5 2.1
90.0 3.3
90.5 3.1
103.0 1.1
104.0 14.5
105.0 1.3
151.0 1.1
152.0 3.2
153.0 1.4
179.0 1.5
180.0 95.2
181.0 100.0
182.0 13.7
183.0 1.0
400 MHz in CDCl3
90 MHz in CDCl3
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| 1H NMR |
399.65 MHz |
| C13 H11 N
|
0.040 g : 0.5 ml CDCl3
|
| N-benzylideneaniline
|
 |
Assign. Shift(ppm)
A 8.433
B 7.891
C 7.46
D 7.378
E 7.22
F 7.20
|
Hz ppm Int.
3370.36 8.434 886
3159.55 7.906 341
3157.35 7.901 396
3153.93 7.892 351
3153.20 7.890 348
3151.98 7.887 207
3150.63 7.884 223
3149.54 7.881 359
2987.06 7.475 99
2986.45 7.473 102
2985.23 7.470 148
2983.03 7.465 1000
2980.83 7.459 815
2977.54 7.451 494
2976.20 7.448 499
2974.37 7.443 119
2972.29 7.438 127
2957.64 7.401 298
2956.79 7.399 164
2955.81 7.396 143
2951.54 7.386 219
2949.46 7.381 619
2948.49 7.378 275
2944.09 7.367 188
2942.26 7.363 425
2940.19 7.357 99
2894.04 7.242 106
2892.82 7.239 217
2891.60 7.236 200
2887.08 7.225 101
2885.38 7.220 453
2884.16 7.217 778
2883.06 7.214 675
2882.32 7.213 431
2881.47 7.210 493
2879.27 7.205 112
2877.69 7.201 291
2876.83 7.199 348
2875.73 7.196 635
2874.63 7.193 403
2872.44 7.188 74
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| 1H NMR |
89.56 MHz |
| C13 H11 N
|
0.045 g : 0.5 ml CDCl3
|
| N-benzylideneaniline
|
|
Assign. Shift(ppm)
A 8.42
B 7.88
C 7.44
D 7.44
E 7.38
F 7.19
G 7.19
|
Hz ppm Int.
753.94 8.419 953
711.06 7.940 252
709.25 7.920 193
708.56 7.912 252
708.06 7.906 218
706.75 7.892 234
705.44 7.877 307
704.31 7.865 266
702.75 7.847 205
701.50 7.833 390
700.25 7.819 149
697.81 7.792 86
675.38 7.542 57
672.94 7.514 119
670.19 7.484 305
669.25 7.473 1000
668.00 7.459 460
666.25 7.440 823
665.38 7.430 375
664.81 7.424 362
664.31 7.418 368
662.75 7.401 726
661.19 7.383 292
660.38 7.374 326
660.00 7.370 335
659.44 7.364 400
657.63 7.343 124
656.06 7.326 107
654.50 7.308 686
653.81 7.301 690
651.88 7.279 198
650.38 7.262 303
649.56 7.253 570
648.94 7.246 401
647.94 7.235 716
647.56 7.231 741
647.06 7.225 744
644.00 7.191 443
641.88 7.168 189
640.44 7.151 318
639.81 7.144 284
638.38 7.128 198
636.50 7.107 101
635.06 7.091 81