4-苯基環(huán)己酮(4894-75-1)核磁圖(1HNMR)
InChI:InChI=1S/C12H14O/c13-12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-5,11H,6-9H2
InChIKey: YKAYMASDSHFOGI-UHFFFAOYSA-N
Smiles:C1(=O)CCC(C2=CC=CC=C2)CC1
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Mass
MS-NW-6827
4-phenylcyclohexanone
C12H14O (Mass of molecular ion: 174)
Source Temperature: 270 °C
Sample Temperature: 190 °C
Reservoir, 75 eV
27.0 7.7
28.0 3.7
29.0 4.2
38.0 1.2
39.0 11.2
40.0 1.3
41.0 7.2
42.0 1.9
43.0 1.6
50.0 4.0
51.0 10.3
52.0 3.1
53.0 2.6
54.0 1.3
55.0 12.4
56.0 4.9
57.0 20.9
57.5 2.7
58.0 8.8
58.5 1.0
59.0 2.6
62.0 1.9
63.0 6.0
64.0 2.0
65.0 7.5
67.0 1.2
68.0 1.6
69.0 1.5
70.0 1.5
73.0 3.0
74.0 1.7
75.0 1.7
76.0 2.3
77.0 11.5
78.0 12.5
79.0 2.5
83.0 2.7
87.0 1.0
89.0 4.1
90.0 1.5
91.0 71.8
92.0 6.5
96.0 1.1
102.0 3.7
103.0 12.7
104.0 100.0
105.0 12.5
115.0 21.0
116.0 6.6
117.0 62.1
118.0 23.6
119.0 66.5
120.0 7.1
127.0 2.3
128.0 3.3
129.0 5.9
130.0 14.9
131.0 5.9
132.0 4.1
141.0 2.9
144.0 1.3
145.0 16.7
146.0 6.7
152.0 1.0
153.0 1.4
154.0 2.8
155.0 1.2
156.0 2.3
159.0 3.6
170.0 1.0
173.0 1.4
174.0 92.4
175.0 12.7
176.0 1.1