2-(3-Chlorophenoxy)-propionic acid(101-10-0) Raman
Product Name2-(3-Chlorophenoxy)-propionic acid
CAS101-10-0
Molecular FormulaC9H9ClO3
Molecular Weight200.62
InChIInChI=1S/C9H9ClO3/c1-6(9(11)12)13-8-4-2-3-7(10)5-8/h2-6H,1H3,(H,11,12)
InChIKey YNTJKQDWYXUTLZ-UHFFFAOYSA-N
SmilesC(O)(=O)C(OC1=CC=CC(Cl)=C1)C
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MassMS-NW-8205 2-(m-chlorophenoxy)propionic acid C9H9ClO3 (Mass of molecular ion: 200)
Source Temperature: 150 °C Sample Temperature: 110 °C Direct, 75 eV
26.0 1.8 27.0 6.9 28.0 2.4 29.0 3.4 37.0 1.0 38.0 3.7 39.0 5.9 43.0 4.7 45.0 9.0 50.0 6.2 51.0 3.8 53.0 1.4 55.0 4.3 61.0 1.7 62.0 3.1 63.0 11.8 64.0 9.0 65.0 12.8 66.0 1.4 73.0 6.9 74.0 3.7 75.0 22.1 76.0 5.0 77.0 2.2 77.5 1.2 85.0 2.3 91.0 18.2 92.0 6.4 93.0 3.1 99.0 8.1 100.0 6.6 101.0 3.1 102.0 2.4 111.0 23.4 112.0 2.8 113.0 7.8 119.0 3.3 120.0 4.6 125.0 1.1 127.0 6.5 128.0 84.9 129.0 8.2 130.0 27.3 131.0 2.0 155.0 100.0 156.0 8.9 157.0 32.2 158.0 2.9 200.0 54.4 201.0 5.7 202.0 17.9 203.0 1.8
400 MHz in CDCl3
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1H NMR 399.65 MHz C9 H9 Cl O3 0.032 g : 0.5 ml CDCl3 2-(m-chlorophenoxy)propionic acid 
Assign. Shift(ppm)
A 10.9 B 7.200 C 6.980 D 6.904 E 6.773 F 4.776 G 1.662
Hz ppm Int.2885.97 7.222 193 2877.73 7.201 393 2869.67 7.181 252 2793.84 6.991 177 2793.11 6.989 188 2792.01 6.987 196 2791.46 6.985 185 2785.78 6.971 152 2785.23 6.970 157 2783.95 6.966 172 2761.05 6.909 244 2758.85 6.904 366 2756.84 6.899 226 2712.15 6.787 169 2711.78 6.786 168 2709.77 6.781 158 2703.90 6.766 155 2701.34 6.760 144 1919.40 4.803 72 1912.44 4.786 228 1905.66 4.769 232 1898.70 4.751 74 667.28 1.670 1000 660.32 1.653 994
KBr disc
nujol mull
