2-ISOPROPOXYETHANOL(109-59-1) IR2
Product Name2-ISOPROPOXYETHANOL
CAS109-59-1
Molecular FormulaC5H12O2
Molecular Weight104.15
InChIInChI=1S/C5H12O2/c1-5(2)7-4-3-6/h5-6H,3-4H2,1-2H3
InChIKey HCGFUIQPSOCUHI-UHFFFAOYSA-N
SmilesC(O)COC(C)C
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MassMS-NW-1324 2-isopropoxyethanol C5H12O2 (Mass of molecular ion: 104)
Source Temperature: 260 °C Sample Temperature: 180 °C Reservoir, 75 eV
15.0 4.4 19.0 3.1 26.0 1.0 27.0 16.3 28.0 1.8 29.0 4.8 31.0 14.7 33.0 4.4 39.0 5.0 40.0 1.0 41.0 22.8 42.0 10.9 43.0 100.0 44.0 3.4 45.0 65.1 46.0 1.7 55.0 2.8 58.0 2.2 59.0 10.8 61.0 3.9 73.0 32.2 74.0 1.5 86.0 1.0 89.0 23.9 90.0 1.1
90 MHz in CDCl3
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1H NMR 89.56 MHz C5 H12 O2 0.04 ml : 0.5 ml CDCl3 2-isopropoxyethanol 
Assign. Shift(ppm)
A 3.70 B 3.63 C 3.52 D 2.57 E 1.181
Hz ppm Int.337.06 3.764 64 332.50 3.713 95 331.00 3.696 138 328.19 3.665 145 324.94 3.629 110 319.56 3.569 199 316.88 3.539 109 315.19 3.520 115 314.06 3.507 77 313.63 3.502 73 313.00 3.495 70 311.69 3.481 66 310.13 3.463 52 229.88 2.567 99 108.75 1.215 1000 102.63 1.146 947
in CDCl3
CCl4 solution
liquid film
4880 A,200 M,liquid
