Product NameACETYLISOEUGENOL
CAS5912-87-8
Molecular FormulaC12H14O3
Molecular Weight206.24
InChI
InChIKey
Smiles

Mass
MS-IW-5499 trans-2-methoxy-4-(1-propenyl)phenyl acetate C12H14O3 (Mass of molecular ion: 206)
Source Temperature: 130 °C Sample Temperature: 100 °C Direct, 75 eV
39.0 1.2
43.0 4.5
51.0 1.1
55.0 2.5
65.0 1.7
77.0 3.3
79.0 1.4
91.0 4.1
103.0 3.6
104.0 3.2
105.0 1.4
107.0 1.5
121.0 3.7
131.0 6.7
132.0 3.1
133.0 5.4
137.0 1.2
147.0 1.5
149.0 16.1
150.0 1.6
163.0 2.6
164.0 100.0
165.0 11.2
166.0 1.0
206.0 19.0
207.0 2.6
400 MHz in CDCl3

| 1H NMR | 399.65 MHz |
| C12 H14 O3 | 0.045 g : 0.5 ml CDCl3 |
| trans-2-methoxy-4-(1-propenyl)phenyl acetate | |
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Assign. Shift(ppm) |
Hz ppm Int.
2777.71 6.951 103
2769.65 6.931 199
2765.75 6.921 108
2763.92 6.916 135
2755.00 6.894 102
2753.17 6.889 78
2746.95 6.874 50
2745.00 6.869 43
2548.83 6.378 38
2547.36 6.374 38
2533.20 6.339 58
2531.49 6.335 60
2479.49 6.205 91
2472.90 6.188 91
2463.75 6.165 59
2457.15 6.149 60
1525.76 3.818 764
915.53 2.291 1000
749.63 1.876 227
747.92 1.872 228
743.04 1.860 227
741.33 1.855 227
in CDCl3

KBr disc

nujol mull

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