VISNAGIN(82-57-5) IR1
Molecular FormulaC13H10O4
Molecular Weight230.22
InChIInChI=1S/C13H10O4/c1-7-5-9(14)12-11(17-7)6-10-8(3-4-16-10)13(12)15-2/h3-6H,1-2H3
InChIKey NZVQLVGOZRELTG-UHFFFAOYSA-N
SmilesC1(C)OC2=CC3OC=CC=3C(OC)=C2C(=O)C=1
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Mass
MS-NW-9006
4-methoxy-7-methylfuro(3,2-g)chromen-5-one
C13H10O4 (Mass of molecular ion: 230)
Source Temperature: 180 °C
Sample Temperature: 120 °C
Direct, 75 eV
18.0 2.5
28.0 2.0
39.0 2.0
43.0 6.4
50.0 1.6
51.0 4.6
53.0 1.4
62.0 1.2
63.0 2.1
67.0 3.3
69.0 1.6
72.0 1.5
74.0 1.7
75.0 2.5
76.0 2.1
77.0 1.9
79.0 1.6
86.0 1.1
87.0 3.8
89.0 1.2
100.0 2.3
101.0 1.0
102.0 1.0
103.0 1.1
104.0 1.5
115.0 6.5
116.0 1.2
117.0 1.0
119.0 1.6
128.0 1.6
132.0 5.0
133.0 4.2
134.0 1.3
144.0 1.0
145.0 2.4
147.0 2.8
160.0 14.2
161.0 3.4
171.0 2.4
172.0 1.7
173.0 2.3
174.0 1.4
184.0 28.0
185.0 4.4
186.0 1.2
187.0 1.4
200.0 3.5
201.0 61.8
202.0 9.7
203.0 1.1
212.0 3.9
213.0 5.1
227.0 2.2
229.0 20.9
230.0 100.0
231.0 15.8
232.0 2.0