
(E)-3-己烯二酸
产品名称
(E)-3-己烯二酸
CAS号29311-53-3
分子式C6H8O4
分子量144.13
InChIInChI=1S/C6H8O4/c7-5(8)3-1-2-4-6(9)10/h1-2H,3-4H2,(H,7,8)(H,9,10)/b2-1+
InChIKeyYHGNXQAFNHCBTK-OWOJBTEDSA-N
SmilesC(O)(=O)C/C=C/CC(O)=O
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Mass
MS-NW-1812
trans-3-hexenedioic acid
C6H8O4 (Mass of molecular ion: 144)
Source Temperature: 200 °C
Sample Temperature: 170 °C
Direct, 75 eV
14.0 1.0
15.0 2.2
17.0 1.3
18.0 6.0
26.0 10.9
27.0 70.5
28.0 18.6
29.0 70.3
30.0 2.2
31.0 5.0
37.0 2.6
38.0 5.2
39.0 50.1
40.0 4.1
41.0 33.4
42.0 15.6
43.0 62.7
44.0 6.2
45.0 57.0
46.0 2.5
47.0 1.0
49.0 2.1
50.0 10.2
51.0 13.8
52.0 7.9
53.0 46.0
54.0 47.7
55.0 90.6
56.0 15.6
57.0 100.0
58.0 17.8
60.0 15.8
61.0 1.2
67.0 2.0
69.0 4.0
70.0 12.3
71.0 5.9
72.0 1.0
73.0 4.1
79.0 1.0
80.0 11.9
81.0 20.7
82.0 7.1
83.0 1.7
84.0 15.9
85.0 5.4
97.0 9.2
98.0 18.7
99.0 16.0
100.0 10.7
102.0 1.6
108.0 84.0
109.0 5.6
126.0 52.2
127.0 5.0
144.0 1.2