2,6-二苯基吡啶(3558-69-8)質(zhì)譜(MS)
InChI:InChI=1S/C17H13N/c1-3-8-14(9-4-1)16-12-7-13-17(18-16)15-10-5-2-6-11-15/h1-13H
InChIKey: PJUOHDQXFNPPRF-UHFFFAOYSA-N
Smiles:C1(C2=CC=CC=C2)=NC(C2=CC=CC=C2)=CC=C1
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Mass
MS-NW-7799
2,6-diphenylpyridine
C17H13N (Mass of molecular ion: 231)
Source Temperature: 150 °C
Sample Temperature: 120 °C
Direct, 75 eV
27.0 1.5
39.0 2.8
50.0 3.5
51.0 7.1
52.0 2.2
62.0 1.3
63.0 3.2
74.0 2.2
75.0 3.4
76.0 4.7
77.0 7.8
78.0 1.4
87.0 1.0
88.0 1.1
89.0 2.0
101.0 3.4
102.0 11.5
103.0 1.8
104.0 1.0
114.0 2.8
114.5 1.4
115.0 2.5
115.5 3.3
126.0 3.1
127.0 6.5
128.0 3.5
152.0 2.0
153.0 1.9
154.0 3.6
202.0 5.9
203.0 2.8
204.0 2.9
228.0 4.3
229.0 2.7
230.0 46.1
231.0 100.0
232.0 17.9
233.0 1.7
90 MHz in CDCl3
400 MHz in CDCl3
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1H NMR |
89.56 MHz |
C17 H13 N
|
0.019 g : 0.5 ml CDCl3
|
2,6-diphenylpyridine
|
 |
Assign. Shift(ppm)
A 8.14
B 7.79
C 7.67
D 7.49
E 7.40
|
Hz ppm Int.
734.75 8.205 425
732.00 8.174 232
731.69 8.170 232
729.94 8.151 232
726.69 8.115 536
724.94 8.095 551
697.25 7.786 200
692.63 7.734 440
689.69 7.701 665
689.19 7.696 713
684.56 7.644 290
679.94 7.593 133
676.69 7.556 167
675.06 7.538 101
672.00 7.504 427
669.56 7.477 361
666.63 7.444 820
664.88 7.424 1000
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1H NMR |
399.65 MHz |
C17 H13 N
|
18.8 mg : 0.5 ml CDCl3
|
2,6-diphenylpyridine
|
 |
Assign. Shift(ppm)
A 8.153
B 7.797
C 7.684
D 7.496
E 7.431
|
Hz ppm Int.
3263.43 8.166 675
3261.96 8.163 943
3259.89 8.157 245
3256.47 8.149 406
3255.00 8.145 874
3253.66 8.142 670
3251.59 8.137 152
3124.88 7.820 194
3117.80 7.802 240
3116.46 7.798 279
3109.25 7.780 354
3077.76 7.702 35
3077.03 7.700 33
3074.34 7.693 901
3070.19 7.683 37
3069.09 7.680 34
3066.77 7.674 561
3066.04 7.672 467
3064.33 7.668 55
3063.96 7.667 56
3007.45 7.526 44
3004.52 7.518 269
3003.42 7.516 436
3001.71 7.511 176
2996.34 7.498 1000
2994.87 7.494 502
2990.11 7.482 327
2988.77 7.479 656
2986.57 7.473 154
2978.39 7.453 47
2976.07 7.447 259
2974.73 7.444 460
2973.39 7.440 254
2969.73 7.431 167
2967.41 7.426 475
2964.97 7.419 136
2961.43 7.411 113
2960.21 7.408 173
2958.86 7.404 92