塔格糖(87-81-0)紅外圖譜(IR2)
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-MMHHZWLHNA-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-6972
D-tagatose
C6H12O6 (Mass of molecular ion: 180)
Source Temperature: 220 °C
Sample Temperature: 140 °C
Direct, 75 eV
14.0 2.5
15.0 14.9
17.0 3.6
18.0 13.7
19.0 12.3
26.0 2.7
27.0 11.6
28.0 4.8
29.0 32.4
30.0 6.2
31.0 58.9
32.0 3.7
33.0 1.7
39.0 4.3
40.0 1.7
41.0 6.8
42.0 16.6
43.0 51.1
44.0 18.1
45.0 17.3
47.0 2.2
49.0 4.9
53.0 1.0
54.0 1.4
55.0 8.7
56.0 5.8
57.0 23.6
58.0 5.4
59.0 3.7
60.0 35.5
61.0 38.1
62.0 1.8
68.0 3.9
69.0 5.6
71.0 24.1
72.0 18.9
73.0 100.0
74.0 6.6
75.0 1.8
77.0 4.7
83.0 1.0
85.0 10.4
86.0 12.3
87.0 2.0
89.0 4.2
90.0 10.5
91.0 3.2
97.0 1.0
101.0 1.9
102.0 2.2
103.0 20.2
104.0 2.6
113.0 2.7
119.0 1.0
121.0 1.8
131.0 7.6
132.0 1.4
149.0 8.6