4-氯甲基聯(lián)苯(1667-11-4)核磁圖(1HNMR)
InChI:InChI=1S/C13H11Cl/c14-10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h1-9H,10H2
InChIKey: HLQZCRVEEQKNMS-UHFFFAOYSA-N
Smiles:C1(C2=CC=CC=C2)=CC=C(CCl)C=C1
-

Mass
MS-NW-7199
4-(chloromethyl)biphenyl
C13H11Cl (Mass of molecular ion: 202)
Source Temperature: 220 °C
Sample Temperature: 190 °C
Reservoir, 75 eV
39.0 2.5
50.0 1.3
51.0 2.2
57.5 1.3
62.0 1.2
63.0 3.3
65.0 1.2
69.5 2.4
70.5 1.9
74.0 1.1
75.0 1.2
76.0 1.8
77.0 1.1
81.5 1.6
82.0 6.2
82.5 6.9
83.0 4.2
83.5 5.8
87.0 1.0
89.0 1.9
101.0 3.1
102.0 1.7
115.0 3.4
128.0 2.0
139.0 2.7
151.0 1.1
152.0 7.7
153.0 1.2
163.0 1.9
164.0 2.3
165.0 19.6
166.0 5.3
167.0 100.0
168.0 15.0
169.0 1.1
202.0 27.1
203.0 4.1
204.0 9.0
205.0 1.3
400 MHz in CDCl3
90 MHz in CDCl3
-

1H NMR |
399.65 MHz |
C13 H11 Cl
|
0.045 g : 0.5 ml CDCl3
|
4-(chloromethyl)biphenyl
|
 |
Assign. Shift(ppm)
A 7.57
B 7.44
C 7.44
D 7.349
E 4.614
|
Hz ppm Int.
3030.03 7.582 489
3029.30 7.580 532
3027.10 7.575 155
3023.44 7.566 416
3022.09 7.562 726
3021.48 7.561 789
3019.65 7.556 132
3017.09 7.550 66
3013.06 7.540 32
2979.98 7.457 137
2978.03 7.452 648
2977.66 7.451 619
2976.93 7.449 365
2975.10 7.445 145
2971.56 7.436 252
2969.60 7.431 810
2968.14 7.427 261
2963.38 7.415 136
2961.91 7.412 234
2959.72 7.406 52
2943.97 7.367 107
2942.63 7.364 193
2941.41 7.360 109
2937.38 7.350 78
2935.30 7.345 186
2933.11 7.340 59
2929.32 7.330 50
2927.98 7.327 83
2926.76 7.324 43
1843.99 4.615 1000
1842.41 4.611 320
-

1H NMR |
89.56 MHz |
C13 H11 Cl
|
0.035 g : 0.5 ml CDCl3
|
4-(chloromethyl)biphenyl
|
 |
Assign. Shift(ppm)
A 7.68 to 7.19
B 4.613
|
Hz ppm Int.
683.44 7.632 201
682.56 7.622 166
681.13 7.606 169
680.69 7.601 166
679.19 7.584 133
678.31 7.574 170
677.13 7.561 246
674.88 7.536 714
673.69 7.523 668
671.00 7.493 312
669.25 7.473 767
666.56 7.443 391
665.63 7.433 359
663.44 7.408 245
662.94 7.403 289
661.00 7.381 312
660.13 7.371 364
659.06 7.359 187
658.38 7.352 303
655.63 7.321 121
654.06 7.304 70
413.19 4.614 1000