2-氯噻噸酮(86-39-5)紅外圖譜(IR2)
分子式:C13H7ClOS
分子量: 246.71
InChI:InChI=1S/C13H7ClOS/c14-8-5-6-12-10(7-8)13(15)9-3-1-2-4-11(9)16-12/h1-7H
InChIKey: ZCDADJXRUCOCJE-UHFFFAOYSA-N
Smiles:C1(=O)C2=C(C=CC=C2)SC2=C1C=C(Cl)C=C2
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Mass
MS-KW-0495
2-chlorothioxanthen-9-one
C13H7ClOS (Mass of molecular ion: 246)
Source Temperature: 170 °C
Sample Temperature: 120 °C
Direct, 75 eV
50.0 1.4
62.0 1.1
63.0 2.7
69.0 4.3
74.0 1.8
75.0 2.1
76.0 1.0
78.0 1.2
82.0 1.5
91.0 13.3
91.5 5.0
92.0 1.3
96.0 1.5
105.0 4.8
105.5 2.9
106.0 1.1
107.0 1.5
108.0 2.7
109.0 5.4
110.0 2.4
113.0 1.0
123.0 6.0
123.5 1.2
124.0 2.3
137.0 1.4
138.0 2.9
139.0 13.9
140.0 1.7
142.0 1.2
173.0 1.5
182.0 4.9
183.0 7.8
184.0 1.4
186.0 1.2
211.0 1.7
217.0 1.8
218.0 28.0
219.0 4.6
220.0 10.6
221.0 1.5
245.0 1.4
246.0 100.0
247.0 15.6
248.0 37.6
249.0 5.6
250.0 1.9