1,1,1-TRICHLORO-2-METHYL-2-PROPANOL HEMIHYDRATE(6001-64-5) MS
Product Name1,1,1-TRICHLORO-2-METHYL-2-PROPANOL HEMIHYDRATE
CAS6001-64-5
Molecular FormulaC8H16Cl6O3
Molecular Weight372.93
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MassMS-NW-1989 1,1,1-trichloro-2-methyl-2-propanol C4H7Cl3O (H2O) (Mass of molecular ion: 176)
Source Temperature: 240 °C Sample Temperature: 180 °C Reservoir, 75 eV
15.0 5.0 17.0 1.3 18.0 4.9 26.0 1.9 27.0 7.2 28.0 1.5 29.0 2.1 31.0 17.3 36.0 1.4 37.0 1.2 38.0 1.2 39.0 4.7 41.0 15.7 42.0 2.2 43.0 27.2 47.0 2.3 49.0 1.5 50.0 1.1 51.0 2.1 53.0 1.6 55.0 1.0 59.0 100.0 60.0 3.5 61.0 3.6 62.0 2.0 63.0 2.8 77.0 15.2 79.0 4.9 82.0 2.0 83.0 3.5 84.0 1.4 85.0 2.3 87.0 1.1 89.0 1.2 91.0 1.0 97.0 6.1 99.0 4.0 105.0 5.1 107.0 1.6 117.0 1.3 119.0 1.1 125.0 13.0 126.0 2.2 127.0 8.1 128.0 1.2 129.0 1.3 161.0 5.1 163.0 4.9 165.0 1.5
90 MHz in CDCl3
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1H NMR 89.56 MHz C4 H7 Cl3 O 0.048 g : 0.5 ml CDCl3 1,1,1-trichloro-2-methyl-2-propanol 
Assign. Shift(ppm)
A 2.6 B 1.651
Hz ppm Int.147.88 1.652 1000 145.69 1.627 28 145.13 1.621 21
in CDCl3
CCl4 solution
KBr disc
nujol mull
4880 A,200 M,powder
