Methyl chloroacetate(96-34-4) MS
Product NameMethyl chloroacetate
CAS96-34-4
Molecular FormulaC3H5ClO2
Molecular Weight108.52
InChIInChI=1S/C3H5ClO2/c1-6-3(5)2-4/h2H2,1H3
InChIKey QABLOFMHHSOFRJ-UHFFFAOYSA-N
SmilesC(OC)(=O)CCl
-
MassMS-NW-2175 methyl chloroacetate C3H5ClO2 (Mass of molecular ion: 108)
Source Temperature: 280 °C Sample Temperature: 170 °C Reservoir, 75 eV
13.0 1.3 14.0 5.2 15.0 35.8 18.0 1.0 27.0 1.2 28.0 5.4 29.0 19.1 30.0 1.3 31.0 3.6 41.0 1.4 42.0 12.2 43.0 1.4 45.0 2.9 47.0 1.5 48.0 3.1 49.0 44.4 50.0 1.6 51.0 14.2 59.0 100.0 60.0 2.2 64.0 16.7 66.0 5.2 76.0 2.4 77.0 27.1 78.0 1.4 79.0 9.2 108.0 6.3 110.0 2.1
parameter in CDCl3
90 MHz in CDCl3
-
1H NMR 300 MHz C3 H5 Cl O2 10.2 mol% in CDCl3 methyl chloroacetate 
Parameter ppm Hz
D(A) 4.083 D(B) 3.802
Hz ppm Int.1224.90 4.083 667 1140.60 3.802 1000
-
1H NMR 89.56 MHz C3 H5 Cl O2 0.02 ml : 0.5 ml CDCl3 methyl chloroacetate Assign. Shift(ppm)
A 4.08 B 3.81
Hz ppm Int.365.56 4.082 584 340.94 3.807 1000 339.19 3.788 26
in CDCl3
CCl4 solution
liquid film
4880 A,200 M,liquid
Yancheng Green Chemicals Co.,Ltd
Ningxia Jinhua Chemical Co.,Ltd
Changde Changlian Chemical Co., Ltd.
Shandong Dexiang International Trade Co., Ltd
Wuxi High Mountain Hi-tech Development Co.,Ltd.
Henan Xiangtong Chemical Co., Ltd.
Hefei TNJ Chemical Industry Co.,Ltd.