4-乙基芐醇(768-59-2)Raman光譜
InChI:InChI=1S/C9H12O/c1-2-8-3-5-9(7-10)6-4-8/h3-6,10H,2,7H2,1H3
InChIKey: YSLBFFIVJGJBSA-UHFFFAOYSA-N
Smiles:C1(CO)=CC=C(CC)C=C1
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Mass
MS-NW-7422
4-ethylbenzyl alcohol
C9H12O (Mass of molecular ion: 136)
Source Temperature: 220 °C
Sample Temperature: 190 °C
Reservoir, 75 eV
27.0 5.2
28.0 1.2
29.0 5.3
31.0 2.3
38.0 1.3
39.0 8.7
40.0 1.1
41.0 4.2
50.0 4.3
51.0 10.0
52.0 2.8
53.0 3.9
55.0 1.0
60.0 2.4
60.5 1.0
62.0 2.2
63.0 5.4
64.0 1.4
65.0 7.6
66.0 1.5
67.0 1.0
74.0 1.8
75.0 1.6
76.0 1.3
77.0 34.3
78.0 7.3
79.0 72.2
80.0 5.4
89.0 3.8
90.0 1.9
91.0 29.5
92.0 3.7
93.0 9.3
102.0 1.8
103.0 9.2
104.0 5.0
105.0 28.3
106.0 3.7
107.0 100.0
108.0 8.3
115.0 2.9
117.0 5.9
118.0 5.0
119.0 9.0
120.0 6.5
121.0 15.1
122.0 1.5
133.0 2.6
134.0 1.3
135.0 9.7
136.0 56.4
137.0 6.1
400 MHz in CDCl3
90 MHz in CDCl3
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| 1H NMR |
399.65 MHz |
| C9 H12 O
|
0.05 ml : 0.5 ml CDCl3
|
| 4-ethylbenzyl alcohol
|
 |
Assign. Shift(ppm)
A 7.190
B 7.134
C 4.500
D 2.91
E 2.608
F 1.204
90MHZ : HSP-05-117
|
Hz ppm Int.
2885.01 7.219 25
2878.78 7.204 245
2870.61 7.183 462
2862.30 7.163 35
2861.08 7.159 33
2854.13 7.142 460
2846.07 7.122 258
1798.71 4.501 765
1161.74 2.907 208
1053.59 2.637 126
1046.02 2.618 327
1038.33 2.599 336
1030.76 2.580 131
489.14 1.224 559
481.45 1.205 1000
473.88 1.186 572
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| 1H NMR |
89.56 MHz |
| C9 H12 O
|
0.05 ml : 0.5 ml CDCl3
|
| 4-ethylbenzyl alcohol
|
|
Assign. Shift(ppm)
A 7.19
B 7.13
C 4.503
D 2.84
E 2.603
F 1.209
400MHZ : HSP-42-240
|
Hz ppm Int.
650.50 7.264 61
649.50 7.253 50
641.75 7.166 1000
640.88 7.156 946
637.75 7.121 130
634.94 7.090 80
633.13 7.070 75
632.06 7.058 84
403.31 4.504 864
254.56 2.843 838
245.19 2.738 86
237.56 2.653 266
230.00 2.569 297
222.50 2.485 117
115.31 1.288 426
107.94 1.206 840
100.19 1.119 328