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2,2',3,3',5,5'-Hexachloro-1,1'-biphenyl
SpectraBase Compound ID KHMOwVKWVUs
InChI InChI=1S/C12H4Cl6/c13-5-1-7(11(17)9(15)3-5)8-2-6(14)4-10(16)12(8)18/h1-4H
InChIKey AJKLKINFZLWHQE-UHFFFAOYSA-N
Mol Weight 360.9 g/mol
Molecular Formula C12H4Cl6
Exact Mass 357.844416 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JzrOh2m9ePZ
Name 2,2',3,3',5,5'-Hexachloro-1,1'-biphenyl
Alternate Name(s) 1,1'-Biphenyl, 2,2',3,3',5,5'-Hexachloro- 1,2,5-trichloro-3-(2,3,5-trichlorophenyl)benzene 1,2,5-tris(chloranyl)-3-[2,3,5-tris(chloranyl)phenyl]benzene 2,2',3,3',5,5'-Hexachlorobiphenyl 2,3,5,2',3',5'-Hexachlorobiphenyl PCB 133 BRN 2288106
CAS Registry Number 35694-04-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H4Cl6
InChI InChI=1S/C12H4Cl6/c13-5-1-7(11(17)9(15)3-5)8-2-6(14)4-10(16)12(8)18/h1-4H
InChIKey AJKLKINFZLWHQE-UHFFFAOYSA-N
Molecular Weight 360.882 g/mol
SMILES c1c(cc(c(c1-c1cc(cc(c1Cl)Cl)Cl)Cl)Cl)Cl
SPLASH splash10-08fv-3945000000-51d25c7d4126edb813fc
Source of Spectrum W5-1989-15242-1
Wiley ID 1346737