Product Name1,4-DICYCLOHEXYLBENZENE
CAS1087-02-1
Molecular FormulaC18H26
Molecular Weight242.4
InChIInChI=1S/C18H26/c1-3-7-15(8-4-1)17-11-13-18(14-12-17)16-9-5-2-6-10-16/h11-16H,1-10H2
InChIKey QQFSIGWYINAJOB-UHFFFAOYSA-N
SmilesC1(C2CCCCC2)=CC=C(C2CCCCC2)C=C1

Mass
MS-NW-1266 p-dicyclohexylbenzene C18H26 (Mass of molecular ion: 242)
Source Temperature: 260 °C Sample Temperature: 180 °C Reservoir, 75 eV
27.0 2.4
29.0 4.4
39.0 3.4
41.0 15.6
43.0 1.8
51.0 1.0
53.0 2.5
55.0 27.3
56.0 1.6
65.0 1.8
67.0 4.3
69.0 1.4
77.0 2.9
78.0 1.3
79.0 2.1
81.0 8.9
82.0 3.4
83.0 38.6
84.0 2.5
91.0 43.8
92.0 5.6
93.0 1.1
103.0 1.6
104.0 6.8
105.0 4.6
115.0 9.0
116.0 3.2
117.0 62.1
118.0 7.5
127.0 2.4
128.0 8.8
129.0 20.6
130.0 8.9
131.0 6.7
141.0 2.7
142.0 1.6
143.0 9.3
144.0 2.0
145.0 1.1
155.0 1.3
157.0 2.5
158.0 4.0
159.0 62.4
160.0 12.6
161.0 1.0
173.0 11.2
174.0 2.0
186.0 13.7
187.0 2.7
199.0 5.3
200.0 2.0
227.0 2.6
242.0 100.0
243.0 19.7
244.0 1.9
400 MHz in CDCl3

| 1H NMR | 399.65 MHz |
| C18 H26 | 13.0 mg : 0.5 ml CDCl3 |
| p-dicyclohexylbenzene | |
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Assign. Shift(ppm) |
Hz ppm Int.
2847.78 7.126 1000
983.52 2.461 34
751.95 1.882 49
750.00 1.877 49
748.17 1.873 49
747.07 1.870 50
743.53 1.861 74
742.68 1.859 74
742.31 1.858 74
739.75 1.851 59
734.99 1.840 64
734.01 1.837 61
732.30 1.833 77
730.22 1.828 60
729.74 1.826 61
726.44 1.818 60
723.88 1.812 50
723.63 1.811 50
722.53 1.808 51
698.85 1.749 32
687.87 1.722 31
686.40 1.718 33
685.06 1.715 33
568.48 1.423 49
567.38 1.420 48
566.04 1.417 50
559.45 1.400 79
558.59 1.398 79
555.30 1.390 114
551.03 1.379 90
546.51 1.368 47
545.53 1.366 53
544.31 1.362 47
542.11 1.357 57
539.31 1.350 37
in CDCl3

KBr disc

nujol mull

1,4-DICYCLOHEXYLBENZENE(1087-02-1) MS Atlas of Related Products