(2-Methoxyethyl)benzene(3558-60-9) MS
Product Name(2-Methoxyethyl)benzene
CAS3558-60-9
Molecular FormulaC9H12O
Molecular Weight136.19
InChIInChI=1S/C9H12O/c1-10-8-7-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3
InChIKey CQLYXIUHVFRXLT-UHFFFAOYSA-N
SmilesC1(CCOC)=CC=CC=C1
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MassMS-IW-8658 (2-methoxyethyl)benzene C9H12O (Mass of molecular ion: 136)
Source Temperature: 220 °C Sample Temperature: 150 °C Reservoir, 75 eV
15.0 1.7 27.0 1.7 28.0 1.0 29.0 2.8 39.0 5.4 41.0 1.2 45.0 100.0 46.0 3.5 50.0 2.7 51.0 7.2 52.0 1.7 58.0 2.2 62.0 1.0 63.0 3.3 65.0 10.9 77.0 8.9 78.0 5.2 79.0 3.2 89.0 2.2 91.0 62.8 92.0 5.4 102.0 1.2 103.0 8.0 104.0 24.8 105.0 7.9 136.0 41.9 137.0 4.1
400 MHz in CDCl3
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1H NMR 399.65 MHz C9 H12 O 0.05 ml : 0.5 ml CDCl3 (2-methoxyethyl)benzene 
Assign. Shift(ppm)
A 7.266 B 7.20 C 7.19 D 3.577 E 3.327 F 2.866
Hz ppm Int.2913.94 7.292 58 2912.84 7.289 84 2911.25 7.285 42 2906.49 7.273 148 2905.52 7.271 177 2904.54 7.268 138 2901.86 7.262 31 2900.39 7.258 75 2898.32 7.253 194 2882.08 7.212 236 2881.59 7.211 243 2879.03 7.204 126 2876.10 7.197 101 2874.88 7.194 146 2874.27 7.192 136 2873.41 7.190 126 2870.73 7.184 112 2868.41 7.178 34 2864.99 7.169 75 2863.65 7.166 45 1436.77 3.596 237 1429.57 3.578 416 1422.49 3.560 252 1329.96 3.328 1000 1152.83 2.885 148 1145.75 2.867 260 1138.55 2.849 137
in CDCl3
liquid film
