乙基環(huán)戊烷(1640-89-7)核磁圖(1HNMR)
InChI:InChI=1S/C7H14/c1-2-7-5-3-4-6-7/h7H,2-6H2,1H3
InChIKey: IFTRQJLVEBNKJK-UHFFFAOYSA-N
Smiles:C1(CC)CCCC1
-
Mass
MS-NW-4000
ethylcyclopentane
C7H14 (Mass of molecular ion: 98)
Source Temperature: 280 °C
Sample Temperature: 180 °C
Reservoir, 75 eV
15.0 1.0
26.0 1.4
27.0 13.7
28.0 2.6
29.0 12.5
38.0 1.2
39.0 18.6
40.0 3.5
41.0 63.7
42.0 41.3
43.0 7.0
50.0 1.0
51.0 1.7
53.0 5.1
54.0 5.3
55.0 47.9
56.0 44.7
57.0 7.4
65.0 1.2
67.0 10.0
68.0 66.4
69.0 100.0
70.0 56.1
71.0 3.2
83.0 8.2
98.0 12.3
99.0 1.0
90 MHz in CDCl3
400 MHz in CDCl3
-
| 1H NMR |
89.56 MHz |
| C7 H14
|
0.04 ml : 0.5 ml CDCl3
|
| ethylcyclopentane
|
 |
Assign. Shift(ppm)
A 1.85 to 1.43
B 1.31
C 1.08
D 0.90
400MHZ : HSP-41-081
|
Hz ppm Int.
165.44 1.848 51
164.38 1.836 58
163.81 1.830 57
162.31 1.813 62
162.00 1.809 62
159.94 1.786 93
158.50 1.770 105
158.00 1.765 110
156.88 1.752 90
153.81 1.718 128
152.81 1.707 130
150.81 1.684 150
149.44 1.669 174
147.94 1.652 173
146.69 1.638 154
144.88 1.618 226
143.06 1.598 271
141.44 1.580 188
140.44 1.569 224
136.88 1.529 321
134.38 1.501 184
133.56 1.492 171
132.56 1.481 149
131.31 1.467 101
130.06 1.453 97
126.50 1.413 46
124.13 1.386 118
118.75 1.326 92
117.31 1.310 112
116.44 1.301 122
111.38 1.244 104
110.56 1.235 111
108.13 1.208 67
106.69 1.192 57
104.75 1.170 77
102.50 1.145 47
100.38 1.121 61
99.56 1.112 60
97.50 1.089 53
97.38 1.088 53
95.94 1.072 64
94.88 1.060 50
94.56 1.056 50
93.06 1.040 71
89.69 1.002 45
89.25 0.997 45
86.88 0.971 244
85.94 0.960 371
84.94 0.949 285
79.44 0.888 1000
78.50 0.877 304
76.94 0.860 130
73.13 0.817 115
71.81 0.802 166
69.81 0.780 98
-
| 1H NMR |
399.65 MHz |
| C7 H14
|
0.05 ml : 0.5 ml CDCl3
|
| ethylcyclopentane
|
|
Assign. Shift(ppm)
A *1 1.72
B 1.67
C *2 1.58
D *2 1.50
E 1.310
F *1 1.073
G 0.888
90MHZ : HSP-03-882
ASSIGNED BY H-H AND C-H COSY.
|
Hz ppm Int.
710.82 1.779 45
709.84 1.777 45
708.98 1.775 41
707.28 1.770 51
705.32 1.765 93
704.83 1.764 96
703.86 1.762 98
702.88 1.759 94
702.03 1.757 87
700.68 1.754 105
699.58 1.751 105
698.36 1.748 111
696.04 1.742 112
695.07 1.740 95
693.48 1.736 134
692.75 1.734 151
690.80 1.729 97
688.96 1.724 99
687.87 1.722 126
686.77 1.719 115
685.55 1.716 117
684.57 1.713 114
682.86 1.709 100
681.88 1.707 136
680.79 1.704 112
674.56 1.688 121
667.36 1.670 136
660.16 1.652 96
652.10 1.632 64
649.29 1.625 42
644.53 1.613 66
642.58 1.608 78
641.60 1.606 97
640.75 1.604 81
640.01 1.602 82
638.79 1.599 104
637.94 1.597 97
637.45 1.596 98
635.01 1.589 156
633.67 1.586 180
631.47 1.581 121
629.76 1.576 123
629.03 1.574 109
627.56 1.571 126
626.83 1.569 127
624.88 1.564 91
624.02 1.562 110
622.56 1.558 73
620.73 1.554 70
619.87 1.552 89
618.65 1.548 79
617.19 1.545 65
614.99 1.539 105
612.06 1.532 57
609.99 1.527 88
608.64 1.523 100
607.54 1.521 128
606.20 1.517 144
605.47 1.516 124
604.00 1.512 86
602.54 1.508 133
599.49 1.501 168
597.90 1.497 139
595.70 1.491 110
595.09 1.490 109
594.24 1.487 122
591.92 1.482 113
590.33 1.478 97
589.60 1.476 71
587.77 1.471 58
586.30 1.468 47
538.21 1.347 90
530.76 1.329 282
523.56 1.311 392
516.48 1.293 349
509.28 1.275 131
445.92 1.116 49
444.58 1.113 51
443.48 1.110 50
440.06 1.102 51
437.50 1.095 108
437.01 1.094 110
435.18 1.089 73
433.96 1.086 90
432.13 1.082 126
429.81 1.076 135
428.10 1.072 96
426.15 1.067 120
425.66 1.066 123
423.95 1.061 113
422.73 1.058 86
419.80 1.051 89
418.33 1.047 105
414.79 1.038 39
411.74 1.031 41
362.18 0.907 617
354.74 0.888 1000
347.29 0.869 550