3-METHOXYPHENETHYL ALCOHOL(5020-41-7) Raman
Product Name3-METHOXYPHENETHYL ALCOHOL
CAS5020-41-7
Molecular FormulaC9H12O2
Molecular Weight152.19
InChIInChI=1S/C9H12O2/c1-11-9-4-2-3-8(7-9)5-6-10/h2-4,7,10H,5-6H2,1H3
InChIKey UPPGEJSCUZMCMW-UHFFFAOYSA-N
SmilesC1(CCO)=CC=CC(OC)=C1
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MassMS-NW-5622 m-methoxyphenethyl alcohol C9H12O2 (Mass of molecular ion: 152)
Source Temperature: 270 °C Sample Temperature: 190 °C Reservoir, 75 eV
15.0 1.4 18.0 1.3 27.0 2.6 28.0 3.2 29.0 1.8 31.0 5.6 38.0 1.9 39.0 8.6 41.0 2.4 43.0 1.4 50.0 3.2 51.0 7.4 52.0 4.5 53.0 2.6 55.0 1.2 62.0 1.5 63.0 5.4 64.0 2.6 65.0 10.9 66.0 1.1 77.0 17.4 78.0 14.0 79.0 7.6 89.0 4.4 90.0 7.6 91.0 43.2 92.0 8.1 93.0 1.9 103.0 1.8 104.0 1.3 105.0 2.3 106.0 3.2 107.0 12.3 108.0 9.4 109.0 12.2 110.0 1.0 121.0 100.0 122.0 63.0 123.0 6.5 124.0 3.5 134.0 7.0 135.0 1.6 138.0 1.7 150.0 1.0 152.0 78.5 153.0 7.8
90 MHz in CDCl3
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1H NMR 89.56 MHz C9 H12 O2 0.04 ml : 0.5 ml CDCl3 m-methoxyphenethyl alcohol 
Assign. Shift(ppm)
A 7.21 B 6.81 C 6.77 D 6.77 E 3.82 F 3.782 G 2.823 J 1.78 CONFIRMED BY LAOCN PROGRAM.
Hz ppm Int.646.81 7.223 40 645.88 7.212 40 638.75 7.133 56 612.94 6.844 62 611.63 6.830 75 609.06 6.801 79 607.56 6.784 92 606.81 6.776 84 606.31 6.770 84 604.69 6.752 136 602.88 6.732 57 349.38 3.902 71 342.50 3.825 160 338.75 3.783 1000 336.19 3.754 112 259.06 2.893 77 252.56 2.821 132 245.88 2.746 58 159.25 1.779 205
in CDCl3
liquid film
4880 A,200 M,liquid
