6-硝基-2-甲基苯甲腈(1885-76-3)Raman光譜
InChI:InChI=1S/C8H6N2O2/c1-6-3-2-4-8(10(11)12)7(6)5-9/h2-4H,1H3
InChIKey: BOTPDHNZLRJZOO-UHFFFAOYSA-N
Smiles:C(#N)C1=C([N+]([O-])=O)C=CC=C1C
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Mass
MS-NW-7958
2-methyl-6-nitrobenzonitrile
C8H6N2O2 (Mass of molecular ion: 162)
Source Temperature: 140 °C
Sample Temperature: 110 °C
Direct, 75 eV
18.0 2.5
26.0 1.0
27.0 3.3
28.0 2.1
30.0 19.7
37.0 3.0
38.0 4.2
39.0 18.9
40.0 1.6
41.0 2.2
50.0 6.2
51.0 8.8
52.0 2.8
53.0 1.3
61.0 3.6
62.0 7.4
63.0 19.7
64.0 7.2
65.0 4.0
66.0 1.0
74.0 1.9
75.0 4.1
76.0 4.7
77.0 17.7
78.0 4.9
86.0 1.2
87.0 3.2
88.0 6.8
89.0 100.0
90.0 14.4
91.0 2.7
102.0 1.9
103.0 1.5
104.0 12.3
105.0 2.9
114.0 3.2
115.0 3.2
116.0 36.1
117.0 3.8
132.0 26.1
133.0 2.6
146.0 1.0
162.0 24.3
163.0 2.8