Product Name3,4-Dichlorobenzyl alcohol
CAS1805-32-9
Molecular FormulaC7H6Cl2O
Molecular Weight177.03
InChIInChI=1S/C7H6Cl2O/c8-6-2-1-5(4-10)3-7(6)9/h1-3,10H,4H2
InChIKey FVJIUQSKXOYFKG-UHFFFAOYSA-N
SmilesC1(CO)=CC=C(Cl)C(Cl)=C1

Mass
MS-NW-7525 3,4-dichlorobenzyl alcohol C7H6Cl2O (Mass of molecular ion: 176)
Source Temperature: 210 °C Sample Temperature: 190 °C Reservoir, 75 eV
27.0 2.2
29.0 8.0
31.0 8.0
36.0 2.0
37.0 4.0
38.0 5.8
39.0 4.6
43.0 2.9
44.0 1.6
49.0 2.8
50.0 13.2
51.0 16.4
52.0 12.7
52.5 1.5
53.0 1.4
55.0 2.2
56.0 3.5
57.0 1.1
60.0 1.6
61.0 5.1
61.5 1.2
62.0 5.5
63.0 6.4
70.0 3.9
70.5 1.3
71.0 1.5
72.0 1.9
73.0 8.2
74.0 14.5
75.0 27.8
76.0 4.3
77.0 100.0
78.0 9.6
84.0 4.9
85.0 5.7
86.0 3.4
87.0 3.7
87.5 3.0
88.0 1.4
88.5 2.0
89.0 4.7
97.0 2.2
99.0 1.8
105.0 2.0
108.0 1.0
109.0 8.3
110.0 3.4
111.0 63.3
112.0 12.2
113.0 58.0
114.0 6.7
115.0 12.9
116.0 1.1
123.0 10.3
124.0 2.8
125.0 3.8
126.0 1.0
133.0 1.6
135.0 1.1
139.0 12.1
140.0 5.3
141.0 96.7
142.0 9.1
143.0 31.1
144.0 2.8
145.0 6.7
146.0 3.0
147.0 23.7
148.0 3.4
149.0 13.9
150.0 1.3
151.0 2.3
159.0 13.4
160.0 1.7
161.0 8.7
163.0 1.7
173.0 4.0
175.0 15.2
176.0 66.0
177.0 13.9
178.0 43.6
179.0 5.0
180.0 7.5
90 MHz in CDCl3

| 1H NMR | 89.56 MHz |
| C7 H6 Cl2 O | 0.039 g : 0.5 ml CDCl3 |
| 3,4-dichlorobenzyl alcohol | |
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Assign. Shift(ppm) |
Hz ppm Int.
666.63 7.444 522
665.88 7.436 444
665.50 7.431 445
664.69 7.422 358
663.88 7.413 448
663.50 7.409 474
658.63 7.355 763
654.69 7.311 51
652.69 7.288 33
651.94 7.280 33
651.81 7.278 33
651.38 7.274 33
650.31 7.262 31
649.50 7.253 30
649.13 7.248 30
644.50 7.197 239
643.88 7.190 405
643.25 7.183 252
642.56 7.175 233
641.94 7.168 345
641.25 7.161 198
638.94 7.135 39
638.38 7.128 36
636.25 7.105 125
635.63 7.098 208
635.00 7.091 135
634.31 7.083 125
633.69 7.076 185
633.06 7.069 108
412.75 4.609 1000
405.06 4.523 41
402.81 4.498 32
210.63 2.352 153
in CDCl3

KBr disc

nujol mull

3,4-Dichlorobenzyl alcohol(1805-32-9) 13C NMR Atlas of Related Products
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