5,6,7,8-四氢-2-萘酚(1125-78-6)红外图谱(IR2)
InChI:InChI=1S/C10H12O/c11-10-6-5-8-3-1-2-4-9(8)7-10/h5-7,11H,1-4H2
InChIKey: UMKXSOXZAXIOPJ-UHFFFAOYSA-N
Smiles:C1=C2C(CCCC2)=CC=C1O
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Mass
MS-NW-4168
5,6,7,8-tetrahydro-2-naphthol
C10H12O (Mass of molecular ion: 148)
Source Temperature: 280 °C
Sample Temperature: 180 °C
Reservoir, 75 eV
18.0 1.1
27.0 3.4
38.0 1.0
39.0 6.3
41.0 3.4
50.0 1.9
51.0 5.5
52.0 2.0
53.0 2.9
55.0 2.7
62.0 1.2
63.0 3.1
64.0 1.4
65.0 5.0
65.5 1.2
66.0 2.1
72.0 1.2
73.0 1.6
74.0 1.1
77.0 6.9
78.0 2.1
79.0 2.1
89.0 1.6
91.0 17.6
92.0 3.2
94.0 2.0
103.0 2.6
104.0 1.8
105.0 2.4
107.0 14.8
108.0 1.3
115.0 4.6
116.0 1.3
117.0 2.1
119.0 5.8
120.0 100.0
121.0 9.0
127.0 2.3
128.0 1.9
129.0 1.7
130.0 1.5
131.0 5.2
132.0 3.6
133.0 6.4
144.0 1.1
145.0 1.7
146.0 1.2
147.0 23.3
148.0 57.4
149.0 6.4
90 MHz in CDCl3
400 MHz in CDCl3
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| 1H NMR |
89.56 MHz |
| C10 H12 O
|
0.049 g : 0.5 ml CDCl3
|
| 5,6,7,8-tetrahydro-2-naphthol
|
 |
Assign. Shift(ppm)
A 6.90
B 6.57
C 6.52
D 5.05
E 2.67
F 1.75
|
Hz ppm Int.
622.88 6.955 165
622.00 6.946 115
615.75 6.876 178
614.25 6.859 231
593.81 6.631 189
591.06 6.600 307
583.94 6.521 723
451.94 5.047 1000
246.13 2.749 194
239.56 2.675 613
238.06 2.659 418
233.13 2.604 267
162.88 1.819 342
159.81 1.785 392
159.00 1.776 417
156.25 1.745 867
154.25 1.723 342
153.06 1.710 403
152.56 1.704 415
149.63 1.671 253
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| 1H NMR |
399.65 MHz |
| C10 H12 O
|
14.0 mg : 0.5 ml CDCl3
|
| 5,6,7,8-tetrahydro-2-naphthol
|
|
Assign. Shift(ppm)
A 6.923
B 6.586
C 6.540
D 4.75
E 2.691
F 1.761
|
Hz ppm Int.
2771.12 6.934 271
2762.82 6.914 299
2637.70 6.601 189
2635.01 6.594 225
2629.52 6.580 160
2626.71 6.573 214
2614.99 6.544 337
2614.62 6.543 346
2612.18 6.537 252
1898.44 4.751 316
1079.96 2.703 337
1076.66 2.695 294
1074.22 2.688 290
1073.49 2.687 291
1070.80 2.680 335
1064.58 2.664 136
716.19 1.793 49
713.99 1.787 66
709.72 1.776 378
706.42 1.768 514
703.13 1.760 1000
699.83 1.752 479
696.41 1.743 317
693.60 1.736 46
692.14 1.732 54
689.94 1.727 41