N-甲基-2-(2-羥乙基)吡咯烷(67004-64-2)核磁圖(1HNMR)
InChI:InChI=1S/C7H15NO/c1-8-5-2-3-7(8)4-6-9/h7,9H,2-6H2,1H3
InChIKey: FYVMBPXFPFAECB-UHFFFAOYSA-N
Smiles:N1(C)CCCC1CCO
-
Mass
MS-NW-5452
1-methyl-2-pyrrolidineethanol
C7H15NO (Mass of molecular ion: 129)
Source Temperature: 260 °C
Sample Temperature: 190 °C
Reservoir, 75 eV
15.0 2.5
18.0 1.3
27.0 3.2
28.0 2.8
29.0 1.6
30.0 1.9
31.0 2.0
39.0 2.9
41.0 5.4
42.0 20.7
43.0 2.3
44.0 6.3
53.0 1.1
54.0 1.4
55.0 3.3
56.0 2.5
57.0 2.6
58.0 1.1
67.0 1.4
68.0 1.5
69.0 1.8
70.0 5.6
82.0 6.5
83.0 2.0
84.0 100.0
85.0 6.1
96.0 1.2
98.0 1.6
110.0 1.3
129.0 1.6
400 MHz in CDCl3
90 MHz in CDCl3
-
| 1H NMR |
399.65 MHz |
| C7 H15 N O
|
0.05 ml : 0.5 ml CDCl3
|
| 1-methyl-2-pyrrolidineethanol
|
 |
Assign. Shift(ppm)
A 5.6
B *1 3.900
C *1 3.647
D *2 3.051
E 2.477
F 2.348
G *2 2.154
J *3 1.93
K *4 1.85
L 1.76
M *3 1.70
N *4 1.62
ASSIGNED BY COSY.
|
Hz ppm Int.
1571.17 3.932 53
1567.02 3.921 56
1562.01 3.909 60
1560.30 3.905 73
1557.86 3.899 62
1556.15 3.894 73
1551.15 3.882 66
1547.00 3.871 65
1467.53 3.673 54
1462.52 3.660 103
1457.03 3.646 80
1451.66 3.633 85
1446.66 3.620 45
1229.13 3.076 42
1226.81 3.070 48
1222.17 3.059 46
1219.85 3.053 85
1217.77 3.048 56
1212.89 3.035 48
1210.57 3.030 49
993.29 2.486 48
991.33 2.481 43
987.30 2.471 45
985.60 2.467 47
984.25 2.463 44
938.60 2.349 1000
874.88 2.190 52
867.31 2.171 75
865.48 2.166 109
857.91 2.147 122
855.96 2.142 75
848.51 2.124 71
781.37 1.956 31
780.27 1.953 47
777.10 1.945 33
773.32 1.935 57
771.48 1.931 51
768.55 1.924 34
767.46 1.921 40
764.65 1.914 39
762.08 1.907 53
759.28 1.900 31
756.35 1.893 35
752.93 1.884 47
751.10 1.880 47
747.31 1.870 35
745.24 1.865 36
742.07 1.857 74
736.21 1.843 76
733.03 1.835 51
731.08 1.830 63
727.66 1.821 62
724.24 1.813 38
721.68 1.806 75
718.99 1.800 58
715.21 1.790 33
714.60 1.789 34
711.79 1.782 71
708.98 1.775 58
706.54 1.768 55
705.32 1.765 42
704.10 1.762 63
701.90 1.757 79
698.85 1.749 68
697.51 1.746 52
696.17 1.742 65
695.19 1.740 82
691.16 1.730 60
688.35 1.723 79
686.40 1.718 41
684.57 1.713 52
680.91 1.704 76
675.90 1.692 37
674.56 1.688 36
673.22 1.685 43
670.53 1.678 42
668.58 1.673 32
658.20 1.647 51
653.81 1.636 67
649.90 1.627 64
645.63 1.616 42
644.04 1.612 37
639.53 1.601 50
635.62 1.591 48
-
| 1H NMR |
89.56 MHz |
| C7 H15 N O
|
0.04 ml : 0.5 ml CDCl3
|
| 1-methyl-2-pyrrolidineethanol
|
|
Assign. Shift(ppm)
A 5.2
B *1 3.939
C *1 3.670
D *2 3.05
E 2.53
F 2.352
G *2 2.17 to 1.72
J *2 1.58
|
Hz ppm Int.
355.44 3.969 34
351.44 3.925 38
346.06 3.865 37
342.19 3.821 40
332.38 3.712 60
327.88 3.662 35
210.75 2.354 1000
208.31 2.326 42
190.31 2.125 45
189.31 2.114 33
181.31 2.025 34
176.31 1.969 30
175.00 1.954 48
169.94 1.898 85
168.50 1.882 35
166.75 1.862 36
164.69 1.839 112
162.75 1.818 85
160.63 1.794 134
158.44 1.770 85
155.63 1.738 102
153.25 1.712 40
151.94 1.697 40
150.63 1.682 49
146.75 1.639 50
142.50 1.592 50