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2,2',4,6,6'-Pentachloro-1,1'-biphenyl
SpectraBase Compound ID LlGkCSD4XdH
InChI InChI=1S/C12H5Cl5/c13-6-4-9(16)12(10(17)5-6)11-7(14)2-1-3-8(11)15/h1-5H
InChIKey MTCPZNVSDFCBBE-UHFFFAOYSA-N
Mol Weight 326.4 g/mol
Molecular Formula C12H5Cl5
Exact Mass 323.883389 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H24ZDiTsAf9
Name 2,2',4,6,6'-Pentachloro-1,1'-biphenyl
CAS Registry Number 56558-16-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H5Cl5
InChI InChI=1S/C12H5Cl5/c13-6-4-9(16)12(10(17)5-6)11-7(14)2-1-3-8(11)15/h1-5H
InChIKey MTCPZNVSDFCBBE-UHFFFAOYSA-N
Molecular Weight 326.437 g/mol
SMILES c1cc(c(c(c1)Cl)-c1c(cc(cc1Cl)Cl)Cl)Cl
SPLASH splash10-004i-4947000000-23aea48dfa0aa4b06a64
Source of Spectrum W5-1989-15229-1
Synonyms 1,1'-Biphenyl, 2,2',4,6,6'-Pentachloro- 1,3,5-trichloro-2-(2,6-dichlorophenyl)benzene 2,4,6,2',6'-Pentachlorobiphenyl 2-[2,6-bis(chloranyl)phenyl]-1,3,5-tris(chloranyl)benzene PCB 104
Wiley ID 1322800