1-Methoxy-2-propyl acetate(108-65-6) 13C NMR
Product Name1-Methoxy-2-propyl acetate
CAS108-65-6
Molecular FormulaC6H12O3
Molecular Weight132.16
InChIInChI=1S/C6H12O3/c1-5(4-8-3)9-6(2)7/h5H,4H2,1-3H3
InChIKey LLHKCFNBLRBOGN-UHFFFAOYSA-N
SmilesC(OC)C(OC(=O)C)C
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MassMS-IW-5091 2-methoxy-1-methylethyl acetate C6H12O3 (Mass of molecular ion: 132)
Source Temperature: 210 °C Sample Temperature: 150 °C Reservoir, 75 eV
15.0 3.9 18.0 1.2 27.0 2.5 28.0 1.5 29.0 5.2 31.0 1.9 39.0 2.8 41.0 9.2 42.0 5.5 43.0 100.0 44.0 5.0 45.0 59.3 46.0 1.4 57.0 3.7 58.0 25.4 59.0 2.7 61.0 1.4 71.0 5.4 72.0 36.8 73.0 4.5 87.0 21.6 88.0 9.9 89.0 6.5
400 MHz in CDCl3
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1H NMR 399.65 MHz C6 H12 O3 0.05 ml : 0.5 ml CDCl3 2-methoxy-1-methylethyl acetate 
Assign. Shift(ppm)
A 5.072 B *1 3.442 C *1 3.401 D 3.373 E 2.063 F 1.233
Hz ppm Int.2037.60 5.099 21 2035.28 5.093 55 2031.13 5.083 62 2029.05 5.078 72 2024.78 5.067 74 2022.71 5.062 58 2018.55 5.051 56 1386.47 3.470 77 1380.49 3.455 71 1375.98 3.443 203 1370.00 3.429 206 1365.36 3.417 185 1361.21 3.407 189 1354.86 3.391 83 1350.71 3.380 134 1348.27 3.374 972 824.22 2.063 1000 820.43 2.053 42 496.09 1.242 601 489.50 1.225 585
in CDCl3
liquid film
