環(huán)辛醇(696-71-9)紅外圖譜(IR1)
InChI:InChI=1S/C8H16O/c9-8-6-4-2-1-3-5-7-8/h8-9H,1-7H2
InChIKey: FHADSMKORVFYOS-UHFFFAOYSA-N
Smiles:C1(O)CCCCCCC1
-
Mass
MS-NW-1321
cyclooctanol
C8H16O (Mass of molecular ion: 128)
Source Temperature: 260 °C
Sample Temperature: 180 °C
Reservoir, 75 eV
15.0 1.5
18.0 2.4
26.0 1.1
27.0 16.5
28.0 3.4
29.0 17.4
30.0 1.2
31.0 7.8
39.0 14.8
40.0 3.2
41.0 43.6
42.0 17.5
43.0 24.1
44.0 24.3
45.0 6.9
51.0 1.3
53.0 5.5
54.0 21.3
55.0 29.2
56.0 21.5
57.0 100.0
58.0 9.8
59.0 1.2
65.0 1.0
66.0 7.4
67.0 41.6
68.0 43.6
69.0 16.0
70.0 3.0
71.0 9.9
72.0 5.0
79.0 1.6
80.0 1.6
81.0 33.3
82.0 40.1
83.0 3.7
84.0 8.7
85.0 9.0
86.0 2.6
95.0 12.7
96.0 1.2
97.0 1.6
98.0 1.5
99.0 5.0
100.0 1.9
110.0 11.3
111.0 1.2
90 MHz in CDCl3
400 MHz in CDCl3
-
| 1H NMR |
89.56 MHz |
| C8 H16 O
|
0.04 ml : 0.5 ml CDCl3
|
| cyclooctanol
|
 |
Assign. Shift(ppm)
A 1.25 to 2.03
B 1.76
C 3.837
|
Hz ppm Int.
343.56 3.837 64
157.13 1.755 368
137.00 1.530 1000
-
| 1H NMR |
399.65 MHz |
| C8 H16 O
|
0.05 ml : 0.5 ml CDCl3
|
| cyclooctanol
|
|
Assign. Shift(ppm)
A 3.823
B 2.46
C *1 1.82
D *2 1.69
E *1 1.65
F 1.52
G *2 1.47
|
Hz ppm Int.
1540.16 3.854 107
1536.25 3.844 187
1531.86 3.834 261
1527.95 3.824 383
1524.05 3.814 225
1519.65 3.803 218
1515.87 3.793 111
981.08 2.455 124
756.59 1.894 40
753.66 1.886 37
750.24 1.878 70
746.83 1.869 41
742.55 1.859 137
739.01 1.850 214
735.47 1.841 183
733.03 1.835 200
730.47 1.828 235
729.13 1.825 244
727.91 1.822 301
726.81 1.819 275
725.34 1.815 284
724.24 1.813 280
721.68 1.806 241
718.26 1.798 307
716.92 1.794 355
713.01 1.785 348
692.02 1.732 101
687.26 1.720 182
684.94 1.714 179
682.25 1.708 165
678.59 1.698 396
676.15 1.692 423
672.73 1.684 267
670.65 1.679 433
668.46 1.673 711
666.63 1.669 474
663.94 1.662 400
660.16 1.652 544
658.08 1.647 328
654.91 1.639 391
652.71 1.634 278
646.24 1.618 287
644.17 1.612 195
640.26 1.603 74
637.08 1.595 115
633.79 1.586 109
630.25 1.578 135
626.46 1.568 157
624.63 1.563 162
623.41 1.560 155
618.65 1.548 493
617.55 1.546 482
614.50 1.538 635
611.57 1.531 543
609.13 1.525 948
607.18 1.520 657
603.52 1.511 1000
600.34 1.503 595
597.90 1.497 666
596.44 1.493 662
592.53 1.483 343
588.50 1.473 460
585.57 1.466 369
583.25 1.460 338
580.57 1.453 338
578.74 1.449 328
573.97 1.437 228
570.56 1.428 152
566.89 1.419 102
563.48 1.410 65
558.96 1.399 36
552.86 1.384 35
547.24 1.370 43