丁香酸(530-57-4)紅外圖譜(IR1)
InChI:InChI=1S/C9H10O5/c1-13-6-3-5(9(11)12)4-7(14-2)8(6)10/h3-4,10H,1-2H3,(H,11,12)
InChIKey: JMSVCTWVEWCHDZ-UHFFFAOYSA-N
Smiles:C(O)(=O)C1=CC(OC)=C(O)C(OC)=C1
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Mass
MS-NW-2350
4-hydroxy-3,5-dimethoxybenzoic acid
C9H10O5 (Mass of molecular ion: 198)
Source Temperature: 230 °C
Sample Temperature: 160 °C
Direct, 75 eV
15.0 5.2
17.0 2.3
18.0 10.9
27.0 1.6
28.0 8.7
29.0 2.9
31.0 1.1
37.0 1.7
38.0 4.2
39.0 9.8
40.0 2.0
41.0 2.6
42.0 1.2
43.0 2.5
44.0 3.5
45.0 2.4
49.0 1.1
50.0 5.6
51.0 6.4
52.0 2.1
53.0 6.0
55.0 2.8
61.0 1.0
62.0 1.4
63.0 1.3
65.0 7.1
66.0 4.3
67.0 7.2
68.0 1.7
69.0 3.5
71.0 2.4
77.0 2.7
78.0 2.3
79.0 6.0
81.0 6.4
82.0 1.4
84.0 5.6
93.0 6.5
94.0 1.1
95.0 2.9
96.0 1.2
97.0 4.3
107.0 1.3
108.0 2.2
109.0 14.6
110.0 2.3
111.0 2.5
112.0 4.3
123.0 3.5
125.0 1.3
127.0 19.2
128.0 1.3
135.0 1.4
137.0 4.8
138.0 1.8
139.0 1.6
140.0 3.1
141.0 1.0
151.0 1.9
152.0 2.2
153.0 3.9
154.0 1.9
155.0 7.9
168.0 1.3
181.0 6.2
182.0 1.2
183.0 29.5
184.0 2.7
197.0 1.3
198.0 100.0
199.0 9.8
200.0 1.5
212.0 1.0