5-苯基海因(89-24-7)質(zhì)譜(MS)
InChI:InChI=1S/C9H8N2O2/c12-8-7(10-9(13)11-8)6-4-2-1-3-5-6/h1-5,7H,(H2,10,11,12,13)
InChIKey: NXQJDVBMMRCKQG-UHFFFAOYSA-N
Smiles:C1(=O)NC(C2=CC=CC=C2)C(=O)N1
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Mass
MS-IW-9381
5-phenyl-2,4-imidazolidinedione
C9H8N2O2 (Mass of molecular ion: 176)
Source Temperature: 180 °C
Sample Temperature: 160 °C
Direct, 75 eV
17.0 1.1
18.0 5.7
26.0 2.2
27.0 11.1
28.0 14.2
29.0 1.4
37.0 1.8
38.0 3.2
39.0 7.2
42.0 2.0
43.0 8.4
44.0 7.9
49.0 1.3
50.0 13.8
51.0 23.0
51.5 2.1
52.0 9.2
52.5 2.4
53.0 1.2
61.0 1.0
62.0 2.3
63.0 5.8
64.0 2.3
70.0 3.6
74.0 3.5
75.0 4.2
76.0 15.3
77.0 31.2
78.0 21.6
79.0 1.5
89.0 6.9
90.0 4.4
102.0 1.3
103.0 36.8
104.0 100.0
105.0 74.4
106.0 8.1
115.0 1.3
116.0 5.0
117.0 4.3
129.0 1.0
130.0 1.7
132.0 3.5
133.0 25.5
134.0 2.6
147.0 2.6
148.0 8.4
158.0 3.1
174.0 1.0
176.0 57.0
177.0 6.4