甘氨酰-D-苏氨酸,二水合物(74807-44-6)Raman光谱
InChI:InChI=1/C6H12N2O4.2H2O/c1-3(9)5(6(11)12)8-4(10)2-7;;/h3,5,9H,2,7H2,1H3,(H,8,10)(H,11,12);2*1H2/t3-,5+;;/s3
InChIKey: BFDXCPYYJSKNOU-PMSOROBYNA-N
Smiles:[C@H](C(=O)O)([C@@H](O)C)NC(=O)CN.O.O |&1:0,4,r|
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![图谱](https://www.chemicalbook.com/Spectrum/74807-44-6_MS_1.jpg)
Mass
MS-NW-1875
glycyl-D-threonine
C6H12N2O4 (Mass of molecular ion: 176)
Source Temperature: 240 °C
Sample Temperature: 240 °C
Direct, 75 eV
15.0 3.3
16.0 2.9
17.0 4.9
18.0 23.5
19.0 1.4
26.0 1.3
27.0 5.0
28.0 17.6
29.0 9.0
30.0 25.7
31.0 2.0
39.0 2.0
40.0 1.0
41.0 2.7
42.0 9.7
43.0 7.7
44.0 38.2
45.0 25.3
46.0 1.7
52.0 1.5
53.0 1.0
54.0 5.1
55.0 5.2
56.0 8.2
57.0 41.7
58.0 5.0
59.0 3.5
67.0 1.2
68.0 2.1
69.0 2.5
70.0 1.1
71.0 3.2
72.0 1.5
73.0 1.8
74.0 1.2
75.0 1.8
83.0 1.5
84.0 1.0
85.0 7.1
86.0 6.4
113.0 1.6
114.0 100.0
115.0 7.2
128.0 6.9
140.0 5.3