N-苄氧羰基-DL-缬氨酸(3588-63-4)核磁图(13CNMR)
分子式:C13H17NO4
分子量: 251.28
InChI:InChI=1S/C13H17NO4/c1-9(2)11(12(15)16)14-13(17)18-8-10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3,(H,14,17)(H,15,16)/t11-/m0/s1
InChIKey: CANZBRDGRHNSGZ-NSHDSACASA-N
Smiles:C(O)(=O)[C@H](C(C)C)NC(OCC1=CC=CC=C1)=O
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![图谱](https://www.chemicalbook.com/Spectrum/3588-63-4_MS.gif)
Mass
MS-NW-2486
N-benzyloxycarbonyl-DL-valine
C13H17NO4 (Mass of molecular ion: 251)
Source Temperature: 200 °C
Sample Temperature: 160 °C
Direct, 75 eV
15.0 1.3
17.0 2.1
18.0 11.1
26.0 1.9
27.0 20.0
28.0 28.7
29.0 5.5
30.0 1.7
31.0 2.0
37.0 1.5
38.0 3.0
39.0 15.5
40.0 2.3
41.0 28.1
42.0 4.8
43.0 46.0
44.0 5.0
50.0 5.4
51.0 12.6
52.0 4.3
53.0 3.6
54.0 2.6
55.0 3.7
56.0 11.2
57.0 1.0
62.0 1.5
63.0 3.7
64.0 1.2
65.0 10.2
68.0 1.2
70.0 1.8
72.0 2.8
73.0 13.4
74.0 4.0
75.0 1.2
76.0 1.0
77.0 29.1
78.0 7.0
79.0 63.3
80.0 6.5
83.0 9.7
89.0 5.2
90.0 7.3
91.0 100.0
92.0 11.1
98.0 2.6
101.0 95.7
102.0 3.8
105.0 3.2
106.0 1.6
107.0 50.3
108.0 98.8
109.0 7.7
116.0 4.8
162.0 8.5
163.0 1.1
206.0 1.8
251.0 1.6