異煙酸-N-氧化物(13602-12-5)核磁圖(1HNMR)
InChI:InChI=1S/C6H5NO3/c8-6(9)5-1-3-7(10)4-2-5/h1-4H,(H,8,9)
InChIKey: QCWTWMJMLSKQCJ-UHFFFAOYSA-N
Smiles:C1[N+]([O-])=CC=C(C(O)=O)C=1
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Mass
MS-IW-0759
isonicotinic acid 1-oxide
C6H5NO3 (Mass of molecular ion: 139)
Source Temperature: 130 °C
Sample Temperature: 130 °C
Direct, 75 eV
18.0 5.5
28.0 2.2
38.0 2.5
39.0 8.9
40.0 1.3
41.0 1.1
45.0 1.3
50.0 3.2
51.0 5.2
52.0 2.1
53.0 1.9
54.0 1.0
55.0 1.9
55.5 1.5
61.0 1.3
62.0 1.3
63.0 3.8
64.0 1.5
65.0 1.7
66.0 2.9
67.0 1.3
77.0 1.3
78.0 4.0
84.0 1.6
92.0 1.1
93.0 1.2
94.0 8.5
95.0 5.7
105.0 1.9
106.0 4.3
111.0 1.3
122.0 18.0
123.0 14.1
124.0 1.1
139.0 100.0
140.0 7.5