Pentachlorophenol(87-86-5) IR1
Product NamePentachlorophenol
CAS87-86-5
Molecular FormulaC6HCl5O
Molecular Weight266.34
InChIInChI=1S/C6HCl5O/c7-1-2(8)4(10)6(12)5(11)3(1)9/h12H
InChIKey IZUPBVBPLAPZRR-UHFFFAOYSA-N
SmilesC1(O)=C(Cl)C(Cl)=C(Cl)C(Cl)=C1Cl
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MassMS-NW-1269 pentachlorophenol C6HCl5O (Mass of molecular ion: 264)
Source Temperature: 250 °C Sample Temperature: 180 °C Reservoir, 75 eV
18.0 1.3 28.0 1.0 35.0 1.5 36.0 3.3 47.0 3.0 48.0 1.6 49.0 1.2 60.0 7.5 61.0 4.4 61.5 1.2 65.0 7.4 66.0 4.8 71.0 3.9 72.0 1.5 73.0 1.4 79.0 1.3 82.5 2.6 83.0 4.1 83.5 2.5 84.0 1.9 85.0 1.7 87.0 4.8 89.0 1.5 95.0 12.5 96.0 5.2 97.0 5.7 98.0 2.4 100.0 7.6 101.0 9.4 102.0 4.6 103.0 1.0 106.0 2.4 107.0 4.2 108.0 1.8 109.0 2.2 114.0 2.7 115.0 3.9 116.0 2.1 117.0 1.8 118.0 1.6 119.0 1.5 120.0 1.0 124.0 1.5 130.0 11.1 131.0 7.9 132.0 10.2 133.0 9.4 134.0 4.5 135.0 1.8 141.0 3.9 142.0 1.3 143.0 3.9 144.0 1.0 145.0 1.3 158.0 1.0 165.0 27.5 166.0 4.0 167.0 26.6 168.0 3.8 169.0 8.9 170.0 1.2 171.0 1.1 194.0 1.7 196.0 1.7 200.0 12.9 201.0 5.5 202.0 16.7 203.0 6.9 204.0 8.2 205.0 3.1 206.0 1.9 228.0 9.7 230.0 18.6 231.0 1.7 232.0 14.7 233.0 1.2 234.0 5.6 235.0 1.8 236.0 1.1 237.0 2.4 239.0 1.5 264.0 63.2 265.0 4.6 266.0 100.0 267.0 7.0 268.0 63.7 269.0 4.4 270.0 20.5 271.0 1.4 272.0 3.3
CCl4 solution
KBr disc
nujol mull
