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Methyl 2-chloropropionate(17639-93-9) MS
Product NameMethyl 2-chloropropionate
CAS17639-93-9
Molecular FormulaC4H7ClO2
Molecular Weight122.55
InChIInChI=1S/C4H7ClO2/c1-3(5)4(6)7-2/h3H,1-2H3
InChIKey JLEJCNOTNLZCHQ-UHFFFAOYSA-N
SmilesC(OC)(=O)C(Cl)C
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MassMS-IW-9106 methyl 2-chloropropionate C4H7ClO2 (Mass of molecular ion: 122)
Source Temperature: 200 °C Sample Temperature: 150 °C Reservoir, 75 eV
15.0 16.6 26.0 5.8 27.0 47.0 28.0 10.0 29.0 4.7 30.0 1.0 31.0 5.1 36.0 1.4 41.0 1.4 43.0 16.0 45.0 1.2 51.0 1.2 53.0 1.0 55.0 7.9 56.0 2.9 59.0 91.2 60.0 2.4 61.0 2.4 62.0 10.5 63.0 100.0 64.0 5.9 65.0 31.9 79.0 1.9 87.0 19.1 91.0 8.3 93.0 2.8 97.0 1.3 122.0 2.3
400 MHz in CDCl3
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1H NMR 399.65 MHz C4 H7 Cl O2 0.05 ml : 0.5 ml CDCl3 methyl 2-chloropropionate 
Assign. Shift(ppm)
A 4.428 B 3.797 C 1.697
Hz ppm Int.1780.03 4.454 80 1773.19 4.437 217 1766.24 4.420 217 1759.28 4.403 79 1517.46 3.797 1000 681.64 1.706 704 674.68 1.689 680
in CDCl3
