2-氯乙氧基乙醇(628-89-7)質譜(MS)
InChI:InChI=1S/C4H9ClO2/c5-1-3-7-4-2-6/h6H,1-4H2
InChIKey: LECMBPWEOVZHKN-UHFFFAOYSA-N
Smiles:C(O)COCCCl
-
Mass
MS-NW-4361
2-(2-chloroethoxy)ethanol
C4H9ClO2 (Mass of molecular ion: 124)
Source Temperature: 230 °C
Sample Temperature: 170 °C
Reservoir, 75 eV
14.0 1.3
15.0 5.1
18.0 1.0
19.0 4.3
26.0 4.2
27.0 53.1
28.0 11.1
29.0 15.5
30.0 2.1
31.0 39.5
36.0 1.4
42.0 3.0
43.0 14.6
44.0 23.8
45.0 100.0
46.0 2.3
49.0 3.3
51.0 1.1
57.0 2.3
58.0 4.6
61.0 2.3
62.0 2.4
63.0 95.2
64.0 2.9
65.0 33.8
75.0 53.9
76.0 2.1
88.0 3.7
93.0 82.8
94.0 3.9
95.0 25.5
96.0 1.2
90 MHz in CDCl3
400 MHz in CDCl3
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| 1H NMR |
89.56 MHz |
| C4 H9 Cl O2
|
0.041 g : 0.5 ml CDCl3
|
| 2-(2-chloroethoxy)ethanol
|
 |
Assign. Shift(ppm)
A 3.97 to 3.44
B 3.57
|
Hz ppm Int.
345.63 3.860 78
342.38 3.823 180
341.56 3.814 119
339.50 3.791 163
337.69 3.771 366
337.31 3.767 375
336.81 3.761 404
336.31 3.756 387
335.38 3.745 299
334.19 3.732 706
333.56 3.725 720
331.56 3.703 995
331.00 3.696 941
327.88 3.662 736
327.38 3.656 750
325.06 3.630 297
324.06 3.619 267
322.81 3.605 293
321.13 3.586 223
319.88 3.572 1000
317.94 3.551 149
314.50 3.512 39
314.00 3.507 38
311.06 3.474 33
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| 1H NMR |
399.65 MHz |
| C4 H9 Cl O2
|
0.05 ml : 0.5 ml CDCl3
|
| 2-(2-chloroethoxy)ethanol
|
|
Assign. Shift(ppm)
A 3.88
B 3.77
C 3.75
D 3.670
E 3.626
|
Hz ppm Int.
1551.03 3.881 1000
1521.12 3.807 31
1520.51 3.805 33
1513.18 3.787 504
1512.33 3.785 486
1507.69 3.773 894
1507.20 3.772 912
1506.23 3.769 593
1505.74 3.768 386
1503.78 3.763 544
1501.83 3.758 840
1501.22 3.757 794
1499.39 3.752 649
1497.92 3.749 441
1496.09 3.744 241
1494.38 3.740 679
1483.64 3.713 39
1482.91 3.711 39
1481.93 3.709 39
1475.95 3.694 45
1471.92 3.684 756
1471.31 3.682 721
1467.41 3.672 383
1466.80 3.671 560
1465.82 3.668 892
1465.33 3.667 751
1462.89 3.661 81
1460.69 3.655 451
1459.96 3.654 436
1453.61 3.638 792
1451.90 3.633 241
1450.07 3.629 445
1448.73 3.625 669
1446.53 3.620 208
1444.21 3.614 520
1439.45 3.602 48