Product NameP-TOLUENESULFONIC ACID 2-METHOXYETHYL ESTER
Molecular FormulaC10H14O4S
Molecular Weight230.28
InChIInChI=1S/C10H14O4S/c1-9-3-5-10(6-4-9)15(11,12)14-8-7-13-2/h3-6H,7-8H2,1-2H3
InChIKey TZXJJSAQSRHKCZ-UHFFFAOYSA-N
SmilesC1(=CC=C(C)C=C1)S(=O)(=O)OCCOC
Mass
MS-IW-2200 2-methoxyethyl p-toluenesulfonate C10H14O4S (Mass of molecular ion: 230)
Source Temperature: 220 °C Sample Temperature: 160 °C Reservoir, 75 eV
15.0 2.6 27.0 1.3 28.0 1.8 29.0 3.7 31.0 2.1 39.0 5.4 41.0 2.1 43.0 2.6 45.0 100.0 46.0 2.5 50.0 1.3 51.0 2.6 58.0 88.2 59.0 6.9 62.0 1.0 63.0 4.4 64.0 1.4 65.0 19.8 66.0 1.1 75.0 2.2 77.0 2.4 79.0 1.1 89.0 5.1 90.0 3.0 91.0 68.4 92.0 6.6 105.0 6.4 107.0 2.0 121.0 4.1 135.0 2.5 139.0 3.2 155.0 37.7 156.0 3.5 157.0 2.0 172.0 10.2 173.0 1.3
400 MHz in CDCl3
1H NMR | 399.65 MHz |
C10 H14 O4 S | 0.05 ml : 0.5 ml CDCl3 |
2-methoxyethyl p-toluenesulfonate |
Assign. Shift(ppm) |
Hz ppm Int.
3119.63 7.806 165 3117.92 7.802 58 3113.16 7.790 62 3111.33 7.786 188 3109.38 7.781 30 2942.75 7.364 121 2942.14 7.362 141 2940.19 7.357 44 2936.16 7.347 46 2934.20 7.342 133 2933.47 7.341 118 1664.31 4.165 175 1661.50 4.158 68 1660.89 4.156 92 1659.67 4.153 172 1658.20 4.150 92 1657.59 4.148 69 1654.91 4.141 198 1430.91 3.581 179 1428.22 3.574 66 1427.61 3.573 86 1426.15 3.569 161 1425.05 3.566 87 1424.44 3.565 65 1421.63 3.558 170 1316.16 3.294 1000 975.59 2.442 454
in CDCl3
liquid film
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