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2,2',4,4',6-Pentachloro-1,1'-biphenyl
SpectraBase Compound ID J0jIFGaBJwc
InChI InChI=1S/C12H5Cl5/c13-6-1-2-8(9(15)3-6)12-10(16)4-7(14)5-11(12)17/h1-5H
InChIKey RKUAZJIXKHPFRK-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 6aKmhuYp1ht
Name 2,2',4,4',6-Pentachloro-1,1'-biphenyl
CAS Registry Number 39485-83-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H5Cl5
InChI InChI=1S/C12H5Cl5/c13-6-1-2-8(9(15)3-6)12-10(16)4-7(14)5-11(12)17/h1-5H
InChIKey RKUAZJIXKHPFRK-UHFFFAOYSA-N
Molecular Weight 326.437 g/mol
SMILES c1cc(c(cc1Cl)Cl)-c1c(cc(cc1Cl)Cl)Cl
SPLASH splash10-004i-5967000000-b2ae200827646baed9c7
Source of Spectrum W5-1989-15215-1
Synonyms 1,1'-Biphenyl, 2,2',4,4',6-Pentachloro- 1,3,5-trichloro-2-(2,4-dichlorophenyl)benzene 1,3,5-tris(chloranyl)-2-(2,4-dichlorophenyl)benzene 2,2',4,4',6-Pentachlorobiphenyl PCB 100
Wiley ID 1322804