3-氯-L-丙氨酸鹽酸鹽(51887-89-9)質(zhì)譜(MS)
InChI:InChI=1/C3H6ClNO2.ClH/c4-1-2(5)3(6)7;/h2H,1,5H2,(H,6,7);1H/t2-;/s3
InChIKey: IENJPSDBNBGIEL-NNUCSGGJNA-N
Smiles:C(O)(=O)[C@H](CCl)N.[H]Cl |&1:3,r|
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Mass
MS-KW-0817
3-chloro-L-alanine hydrochloride
C3H6ClNO2 HCl (Mass of molecular ion: 123)
Source Temperature: 180 °C
Sample Temperature: 160 °C
Direct, 75 eV
14.0 1.0
15.0 9.6
17.0 1.5
18.0 4.6
26.0 1.5
27.0 3.1
28.0 21.9
29.0 3.2
30.0 1.3
35.0 6.2
36.0 63.8
37.0 2.3
38.0 21.8
39.0 1.6
40.0 4.2
41.0 15.4
42.0 55.4
43.0 17.2
44.0 8.7
45.0 4.8
46.0 2.2
49.0 2.2
68.0 1.0
69.0 4.7
70.0 1.2
74.0 32.9
75.0 1.1
76.0 1.8
78.0 100.0
79.0 2.9
80.0 31.7
81.0 1.0
87.0 1.2