D-果糖(57-48-7)質(zhì)譜(MS)
InChI:InChI=1/C6H12O6/c7-1-3(9)5(11)6(12)4(10)2-8/h3,5-9,11-12H,1-2H2/t3-,5-,6-/s3
InChIKey: BJHIKXHVCXFQLS-PEYWYYQWNA-N
Smiles:[C@@H](O)([C@H](O)CO)[C@H](O)C(=O)CO |&1:0,2,6,r|
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Mass
MS-NW-6323
D-fructose
C6H12O6 (Mass of molecular ion: 180)
Source Temperature: 210 °C
Sample Temperature: 160 °C
Direct, 75 eV
14.0 3.5
15.0 21.8
17.0 1.8
18.0 6.6
19.0 13.2
26.0 3.6
27.0 12.7
28.0 4.7
29.0 40.7
30.0 7.6
31.0 74.0
32.0 4.3
33.0 2.4
39.0 4.8
40.0 2.0
41.0 8.0
42.0 23.5
43.0 65.9
44.0 23.8
45.0 21.5
47.0 2.6
49.0 5.9
53.0 1.2
54.0 1.5
55.0 9.9
56.0 6.4
57.0 29.4
58.0 5.6
59.0 5.4
60.0 49.9
61.0 46.7
62.0 2.6
68.0 3.8
69.0 8.9
70.0 1.1
71.0 24.5
72.0 20.0
73.0 100.0
74.0 7.9
75.0 1.8
77.0 6.0
83.0 1.1
85.0 13.9
86.0 14.8
87.0 2.8
89.0 4.5
90.0 7.5
91.0 2.8
97.0 1.5
101.0 2.3
102.0 2.4
103.0 26.8
104.0 2.3
113.0 3.2
115.0 1.0
119.0 1.5
121.0 1.1
131.0 5.9
132.0 1.0
133.0 1.0
144.0 1.0
149.0 8.2