N-三氟乙?;?D-葡萄糖胺(36875-26-0)紅外圖譜(IR1)
分子式:C8H12F3NO6
分子量: 275.18
InChI:InChI=1S/C8H12F3NO6/c9-8(10,11)7(18)12-3(1-13)5(16)6(17)4(15)2-14/h1,3-6,14-17H,2H2,(H,12,18)/t3-,4+,5+,6+/m0/s1
InChIKey: AIJZHZABXNACMO-SLPGGIOYSA-N
Smiles:O=C[C@H](NC(C(F)(F)F)=O)[C@H]([C@@H]([C@@H](CO)O)O)O
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Mass
MS-NW-2024
n-trifluoroacetyl-D-glucosamine
C8H12F3NO6 (Mass of molecular ion: 275)
Source Temperature: 210 °C
Sample Temperature: 210 °C
Direct, 75 eV
12.0 1.2
13.0 2.1
14.0 8.0
15.0 41.9
16.0 1.0
17.0 6.2
18.0 29.3
19.0 10.1
20.0 2.4
25.0 1.6
26.0 7.2
27.0 18.2
28.0 44.5
29.0 73.2
30.0 16.8
31.0 87.7
32.0 29.1
33.0 7.8
38.0 1.6
39.0 4.3
40.0 3.7
41.0 5.4
42.0 27.5
43.0 61.5
44.0 23.9
45.0 8.6
46.0 4.7
47.0 5.3
50.0 6.8
51.0 6.1
52.0 1.7
53.0 2.0
54.0 3.6
55.0 18.0
56.0 29.8
57.0 8.1
58.0 25.9
59.0 2.4
60.0 38.8
61.0 31.1
62.0 1.3
66.0 1.4
68.0 2.5
69.0 100.0
70.0 4.0
71.0 7.4
72.0 11.8
73.0 8.3
74.0 8.1
76.0 1.0
78.0 35.5
79.0 3.9
80.0 2.3
81.0 1.0
82.0 2.2
83.0 2.0
84.0 3.8
85.0 2.3
86.0 17.3
87.0 1.0
88.0 1.9
90.0 1.0
91.0 4.1
94.0 1.4
95.0 1.7
96.0 2.8
97.0 8.2
98.0 4.4
100.0 1.3
103.0 1.2
106.0 2.6
109.0 1.3
110.0 1.5
114.0 1.9
126.0 81.3
127.0 70.1
128.0 3.0
138.0 1.7
139.0 1.0
140.0 4.1
155.0 3.8
156.0 1.2
168.0 10.4
169.0 2.2
179.0 3.4
180.0 1.3
197.0 1.8