Product Name3-METHYLCINNAMIC ACID
CAS14473-89-3
Molecular FormulaC10H10O2
Molecular Weight162.19
InChI
InChIKey
Smiles

Mass
MS-KW-0541 3-methylcinnamic acid C10H10O2 (Mass of molecular ion: 162)
Source Temperature: 220 °C Sample Temperature: 150 °C Reservoir, 75 eV
18.0 2.4
27.0 2.7
28.0 1.9
38.0 1.8
39.0 13.7
40.0 1.4
41.0 2.7
43.0 4.5
44.0 2.0
45.0 5.3
50.0 5.3
51.0 10.2
52.0 3.5
53.0 2.3
55.0 2.0
57.0 3.8
57.5 9.0
58.0 6.4
58.5 1.9
60.0 2.8
61.0 1.2
62.0 3.8
63.0 10.7
64.0 2.3
65.0 14.9
66.0 2.2
69.0 1.7
72.0 2.3
72.5 2.0
74.0 2.6
75.0 3.4
76.0 2.1
77.0 6.6
78.0 2.8
79.0 3.2
80.0 7.7
86.0 1.1
87.0 1.5
89.0 8.3
90.0 2.5
91.0 31.7
92.0 4.7
93.0 2.4
101.0 1.5
102.0 5.0
103.0 8.4
104.0 1.1
105.0 10.6
106.0 1.6
107.0 1.2
108.0 1.2
113.0 1.0
114.0 1.5
115.0 50.7
116.0 23.9
117.0 30.0
118.0 6.9
119.0 8.7
120.0 1.8
121.0 1.4
133.0 4.2
134.0 3.7
143.0 1.0
144.0 8.1
145.0 26.4
146.0 3.1
147.0 63.2
148.0 6.4
161.0 66.1
162.0 100.0
163.0 11.0
400 MHz in CDCl3

| 1H NMR | 399.65 MHz |
| C10H10O2 | 0.039 g : 0.5 ml CDCl3 |
| trans-3-methylcinnamic acid | |
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Assign. Shift(ppm) |
Hz ppm Int.
4864.87 12.169 1
4712.64 11.789 6
4530.75 11.334 1
3110.20 7.780 235
3094.26 7.740 249
2937.46 7.348 224
2936.36 7.345 227
2935.81 7.344 236
2933.25 7.338 154
2932.51 7.336 157
2931.23 7.333 169
2917.13 7.297 142
2914.01 7.289 28
2909.43 7.278 225
2906.14 7.270 38
2901.56 7.258 132
2885.62 7.218 150
2878.11 7.200 91
2579.34 6.452 379
2563.41 6.412 354
1007.67 2.521 8
975.98 2.442 5
945.21 2.365 1000
881.28 2.205 8
in CDCl3

KBr disk

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3-METHYLCINNAMIC ACID(14473-89-3) IR2 Atlas of Related Products
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