Product Name4-Bromo-2,6-dimethylphenol
CAS2374-05-2
Molecular FormulaC8H9BrO
Molecular Weight201.06
InChIInChI=1S/C8H9BrO/c1-5-3-7(9)4-6(2)8(5)10/h3-4,10H,1-2H3
InChIKey ZLVFYUORUHNMBO-UHFFFAOYSA-N
SmilesC1(O)=C(C)C=C(Br)C=C1C

Mass
MS-NW-9131 4-bromo-2,6-xylenol C8H9BrO (Mass of molecular ion: 200)
Source Temperature: 260 °C Sample Temperature: 150 °C Reservoir, 75 eV
27.0 3.5
38.0 1.7
39.0 9.1
40.0 1.1
41.0 3.5
43.0 3.9
45.0 4.5
46.0 2.3
50.0 3.3
51.0 9.4
52.0 3.1
53.0 5.7
55.0 2.2
59.0 1.5
60.0 2.2
60.5 1.3
61.0 1.0
62.0 2.2
63.0 5.2
64.0 1.5
65.0 11.0
66.0 1.7
67.0 1.3
74.0 1.1
75.0 1.4
76.0 1.1
77.0 39.3
78.0 7.9
79.0 1.6
89.0 2.0
90.0 1.4
91.0 39.1
92.0 16.6
93.0 10.3
94.0 1.1
99.0 1.1
100.0 2.6
101.0 1.8
102.0 2.6
103.0 16.7
104.0 2.1
107.0 2.2
119.0 1.2
120.0 1.8
121.0 100.0
122.0 10.9
171.0 1.0
182.0 1.1
184.0 1.1
185.0 3.8
187.0 3.3
199.0 6.5
200.0 93.5
201.0 14.4
202.0 90.9
203.0 8.0
90 MHz in CDCl3

| 1H NMR | 89.56 MHz |
| C8 H9 Br O | 0.047 g : 0.5 ml CDCl3 |
| 4-bromo-2,6-xylenol | |
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Assign. Shift(ppm) |
Hz ppm Int.
634.88 7.089 148
634.25 7.082 199
633.56 7.075 156
197.31 2.204 554
196.69 2.197 1000
196.06 2.190 560
in CDCl3

KBr disc

Nujol


4-Bromo-2,6-dimethylphenol(2374-05-2) Raman Atlas of Related Products
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