2-氯吡啶(109-09-1)红外图谱(IR1)
InChI:InChI=1S/C5H4ClN/c6-5-3-1-2-4-7-5/h1-4H
InChIKey: OKDGRDCXVWSXDC-UHFFFAOYSA-N
Smiles:C1(Cl)=NC=CC=C1
-
![图谱](https://www.chemicalbook.com/Spectrum/109-09-1_MS.gif)
Mass
MS-NW-4434
2-chloropyridine
C5H4ClN (Mass of molecular ion: 113)
Source Temperature: 240 °C
Sample Temperature: 170 °C
Reservoir, 75 eV
26.0 4.5
27.0 4.8
28.0 2.0
37.0 2.2
38.0 3.0
39.0 2.5
49.0 3.1
50.0 13.4
51.0 32.5
52.0 9.6
56.5 1.9
60.0 2.0
62.0 1.3
73.0 1.1
75.0 2.5
76.0 4.2
77.0 1.1
78.0 100.0
79.0 6.3
85.0 1.6
86.0 1.5
113.0 69.9
114.0 4.4
115.0 23.5
116.0 1.4
90 MHz in CDCl3
parameter in CCl4
-
![图谱](https://www.chemicalbook.com/Spectrum/109-09-1_1HNMR_2.jpg)
1H NMR |
89.56 MHz |
C5 H4 Cl N
|
0.02 ml : 0.5 ml CDCl3
|
2-chloropyridine
|
![ChemicalStructure](Spectrum/109-09-1_1HNMR_2_0.jpg) |
Assign. Shift(ppm)
A 8.387
B 7.642
C 7.32
D 7.23
J(A,D)=4.8HZ. J(A,B)=2.0HZ. J(A,C)=0.7HZ.
|
Hz ppm Int.
755.13 8.432 236
754.38 8.424 272
753.13 8.410 294
752.31 8.401 288
750.31 8.378 278
749.63 8.371 292
748.25 8.355 318
747.50 8.347 301
694.63 7.757 357
692.56 7.733 348
687.44 7.676 480
686.56 7.666 573
685.31 7.652 462
684.50 7.643 581
679.38 7.586 810
677.31 7.563 761
660.63 7.377 540
659.44 7.364 966
658.56 7.354 826
652.81 7.290 880
651.69 7.277 1000
650.50 7.264 446
648.00 7.236 667
646.81 7.223 523
645.63 7.209 514
644.44 7.196 455
640.81 7.156 444
639.56 7.142 400
-
![图谱](https://www.chemicalbook.com/Spectrum/109-09-1_1HNMR.gif)
1H NMR |
300 MHz |
C5 H4 Cl N
|
10 mol% in CCl4
|
2-chloropyridine
|
![ChemicalStructure](Spectrum/109-09-1_1HNMR_2_0.jpg) |
Parameter ppm Hz
D(A) 8.320
D(B) 7.162
D(C) 7.592
D(D) 7.257
J(A,B) 4.83
J(A,C) 1.97
J(A,D) 0.88
J(B,C) 7.41
J(B,D) 0.97
J(C,D) 7.98
COX,R.H. & BOTHNER-BY,A.A. J.PHYS.CHEM. 73, 2465 (1969)
|
Hz ppm Int.
2499.84 8.333 491
2498.99 8.330 530
2497.89 8.326 542
2497.03 8.323 522
2495.03 8.317 525
2494.17 8.314 551
2493.06 8.310 551
2492.21 8.307 515
2286.53 7.622 377
2284.58 7.615 373
2279.07 7.597 562
2278.60 7.595 588
2277.13 7.590 568
2276.65 7.589 565
2271.16 7.571 497
2269.20 7.564 486
2181.83 7.273 573
2180.95 7.270 1000
2180.05 7.267 612
2173.85 7.246 501
2172.97 7.243 854
2172.07 7.240 513
2155.05 7.183 522
2154.10 7.180 491
2150.23 7.167 519
2149.28 7.164 505
2147.68 7.159 491
2146.71 7.156 455
2142.84 7.143 450
2141.89 7.140 429