Alachlor(15972-60-8) 1H NMR
Product NameAlachlor
CAS15972-60-8
Molecular FormulaC14H20ClNO2
Molecular Weight269.77
InChIInChI=1S/C14H20ClNO2/c1-4-11-7-6-8-12(5-2)14(11)16(10-18-3)13(17)9-15/h6-8H,4-5,9-10H2,1-3H3
InChIKey XCSGPAVHZFQHGE-UHFFFAOYSA-N
SmilesC(N(C1=C(CC)C=CC=C1CC)COC)(=O)CCl
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MassMS2001-00704WA alachlor C14H20ClNO2 (Mass of molecular ion: 269)
Source Temperature: 185 °C Sample Temperature: 25 °C Direct, 70 eV
15.0 4.2 27.0 2.9 29.0 7.2 39.0 4.4 41.0 3.0 42.0 8.1 43.0 3.8 44.0 1.1 45.0 100.0 46.0 2.2 49.0 18.1 51.0 5.9 52.0 1.7 53.0 1.5 59.0 1.8 63.0 3.0 64.0 1.2 65.0 6.4 66.0 1.3 75.0 1.1 77.0 20.5 78.0 5.4 79.0 7.1 89.0 4.4 90.0 3.8 91.0 23.8 92.0 2.9 93.0 2.6 102.0 3.1 103.0 10.7 104.0 4.8 105.0 12.3 106.0 2.9 115.0 14.6 116.0 3.7 117.0 31.6 118.0 24.3 119.0 7.2 120.0 4.2 121.0 2.1 127.0 2.2 128.0 6.9 129.0 3.1 130.0 30.6 131.0 13.8 132.0 29.9 133.0 5.2 134.0 3.2 142.0 3.2 143.0 4.4 144.0 16.1 145.0 6.4 146.0 44.0 147.0 10.6 148.0 11.9 149.0 5.6 156.0 2.1 157.0 1.2 158.0 11.8 159.0 6.7 160.0 90.4 161.0 15.0 162.0 19.0 163.0 2.6 164.0 4.7 165.0 1.1 170.0 1.6 172.0 8.0 173.0 3.0 174.0 11.8 175.0 7.1 176.0 6.3 177.0 1.7 178.0 1.2 180.0 1.1 186.0 4.6 187.0 1.2 188.0 74.7 189.0 11.9 190.0 17.5 191.0 4.0 192.0 1.8 194.0 2.6 196.0 3.2 198.0 1.6 202.0 12.3 203.0 1.9 206.0 7.7 207.0 3.2 208.0 6.7 209.0 1.7 210.0 2.1 220.0 2.5 222.0 2.4 224.0 24.7 225.0 3.7 226.0 10.0 227.0 1.5 234.0 9.7 235.0 1.7 237.0 30.3 238.0 21.1 239.0 12.6 240.0 7.8 241.0 1.1 269.0 22.3 270.0 3.6 271.0 7.5 272.0 1.2
in CDCl3
in CDCl3
KBr disk
Nujol
