2,5-二特丁基對苯二酚(88-58-4)紅外圖譜(IR1)
InChI:InChI=1S/C14H22O2/c1-13(2,3)9-7-12(16)10(8-11(9)15)14(4,5)6/h7-8,15-16H,1-6H3
InChIKey: JZODKRWQWUWGCD-UHFFFAOYSA-N
Smiles:C1(O)=CC(C(C)(C)C)=C(O)C=C1C(C)(C)C
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Mass
MS-NW-8128
2,5-di-tert-butylhydroquinone
C14H22O2 (Mass of molecular ion: 222)
Source Temperature: 170 °C
Sample Temperature: 110 °C
Direct, 75 eV
18.0 1.1
29.0 2.0
39.0 1.1
41.0 4.9
43.0 5.5
53.0 1.0
55.0 2.1
57.0 16.6
67.0 1.3
69.0 2.3
71.0 4.1
77.0 1.4
79.0 1.1
81.0 2.2
82.0 3.2
91.0 1.8
96.0 1.2
105.0 1.2
107.0 1.0
115.0 1.3
123.0 2.4
137.0 4.1
149.0 1.3
151.0 3.5
163.0 1.7
165.0 1.4
177.0 2.2
179.0 3.0
191.0 2.7
192.0 2.8
207.0 100.0
208.0 14.5
209.0 1.4
222.0 50.7
223.0 7.9
parameter in DMSO-d6
400 MHz in DMSO-d6
90 MHz in DMSO-d6
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| 1H NMR |
300 MHz |
| C14 H22 O2
|
0.045 g : 0.5 ml DMSO-d6
|
| 2,5-di-tert-butylhydroquinone
|
 |
Parameter ppm Hz
D(A) 8.36
D(B) 6.60
D(C) 1.294
|
Hz ppm Int.
2507.99 8.360 53
1980.01 6.600 111
388.22 1.294 1000
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| 1H NMR |
399.65 MHz |
| C14 H22 O2
|
0.045 g : 0.5 ml DMSO-d6
|
| 2,5-di-tert-butylhydroquinone
|
|
Assign. Shift(ppm)
A 8.36
B 6.600
C 1.294
|
Hz ppm Int.
3339.60 8.357 124
2637.82 6.601 147
517.09 1.294 1000
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| 1H NMR |
89.56 MHz |
| C14 H22 O2
|
0.045 g : 0.5 ml DMSO-d6
|
| 2,5-di-tert-butylhydroquinone
|
|
Assign. Shift(ppm)
A 8.32
B 6.594
C 1.290
|
Hz ppm Int.
745.38 8.323 169
590.56 6.595 126
115.50 1.290 1000