Butyl 2,4-dichlorophenoxyacetate(94-80-4) MS
Product NameButyl 2,4-dichlorophenoxyacetate
CAS94-80-4
Molecular FormulaC12H14Cl2O3
Molecular Weight277.14
InChIInChI=1S/C12H14Cl2O3/c1-2-3-6-16-12(15)8-17-11-5-4-9(13)7-10(11)14/h4-5,7H,2-3,6,8H2,1H3
InChIKey UQMRAFJOBWOFNS-UHFFFAOYSA-N
SmilesC(OCCCC)(=O)COC1=CC=C(Cl)C=C1Cl
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MassMS2001-00908WA 2,4-PA-butyl C12H14Cl2O3 (Mass of molecular ion: 276)
Source Temperature: 230 °C Sample Temperature: 300 °C Reservoir, 70 eV
18.0 1.4 27.0 7.7 28.0 3.1 29.0 32.7 31.0 1.3 39.0 6.7 41.0 47.9 42.0 7.2 43.0 6.5 44.0 2.2 50.0 2.7 51.0 1.7 53.0 1.3 55.0 9.1 56.0 8.3 57.0 98.5 58.0 4.2 62.0 2.4 63.0 7.5 73.0 4.3 74.0 6.2 75.0 9.7 76.0 1.1 77.0 2.1 83.0 1.2 84.0 1.8 85.0 1.8 97.0 2.0 98.0 3.1 99.0 1.9 100.0 1.1 107.0 1.1 109.0 17.6 110.0 5.1 111.0 21.2 112.0 5.2 113.0 5.9 114.0 1.3 126.0 2.1 128.0 1.8 133.0 9.7 135.0 6.2 137.0 1.0 139.0 1.4 141.0 1.8 143.0 1.2 145.0 27.9 146.0 2.8 147.0 24.2 148.0 2.0 149.0 7.2 156.0 1.3 161.0 9.9 162.0 49.9 163.0 9.5 164.0 31.7 165.0 3.1 166.0 5.1 173.0 1.4 175.0 61.4 176.0 13.7 177.0 39.3 178.0 8.6 179.0 6.6 180.0 1.4 184.0 4.3 185.0 100.0 186.0 9.9 187.0 31.8 188.0 2.8 220.0 32.7 221.0 3.1 222.0 21.0 223.0 2.0 224.0 3.5 241.0 1.0 276.0 84.2 277.0 10.9 278.0 54.2 279.0 7.0 280.0 9.0 281.0 1.3
in CDCl3
in CDCl3
Liquid film
