1,1,1,2,3,3,3-Heptachloropropane(3849-33-0) IR1
Product Name1,1,1,2,3,3,3-Heptachloropropane
CAS3849-33-0
Molecular FormulaC3HCl7
Molecular Weight285.21
InChIInChI=1S/C3HCl7/c4-1(2(5,6)7)3(8,9)10/h1H
InChIKey LZOUTMTXULWVSU-UHFFFAOYSA-N
SmilesC(Cl)(Cl)(Cl)C(Cl)C(Cl)(Cl)Cl
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MassMS-IW-5641 1,1,1,2,3,3,3-heptachloropropane C3HCl7 (Mass of molecular ion: 282)
Source Temperature: 230 °C Sample Temperature: 150 °C Reservoir, 75 eV
36.0 3.0 37.0 1.3 47.0 1.8 53.0 1.6 54.0 1.0 60.0 1.6 71.0 3.2 72.0 2.9 73.0 1.1 82.0 2.2 83.0 2.0 84.0 1.4 85.0 1.3 95.0 1.6 97.0 1.0 106.0 4.1 107.0 6.7 108.0 3.8 109.0 2.6 117.0 100.0 118.0 1.1 119.0 95.6 120.0 1.0 121.0 30.9 123.0 3.4 130.0 5.0 132.0 4.8 134.0 1.5 141.0 1.5 143.0 1.6 165.0 3.2 167.0 4.1 169.0 1.9 177.0 5.9 179.0 7.7 181.0 3.8 211.0 1.7 213.0 2.8 215.0 1.8 247.0 5.4 249.0 10.4 251.0 8.3 253.0 3.6
parameter in CDCl3
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1H NMR 300 MHz C3 H Cl7 0.02 ml : 0.5 ml CDCl3 1,1,1,2,3,3,3-heptachloropropane 
Parameter ppm Hz
D(A) 5.287
Hz ppm Int.1586.10 5.287 1000
in CDCl3
liquid film
4880 A,200 M,liquid
