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2,2',3,4,5,6,6'-Heptachloro-1,1'-biphenyl
SpectraBase Compound ID 7iYZtBX9CFH
InChI InChI=1S/C12H3Cl7/c13-4-2-1-3-5(14)6(4)7-8(15)10(17)12(19)11(18)9(7)16/h1-3H
InChIKey FGDPOTMRBQHPJK-UHFFFAOYSA-N
Mol Weight 395.3 g/mol
Molecular Formula C12H3Cl7
Exact Mass 391.805444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JkE8WezxLsl
Name 2,2',3,4,5,6,6'-Heptachloro-1,1'-biphenyl
Alternate Name(s) 1,1'-Biphenyl, 2,2',3,4,5,6,6'-Heptachloro- 1,2,3,4,5-pentachloro-6-(2,6-dichlorophenyl)benzene 1-[2,6-bis(chloranyl)phenyl]-2,3,4,5,6-pentakis(chloranyl)benzene PCB 186
CAS Registry Number 74472-49-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H3Cl7
InChI InChI=1S/C12H3Cl7/c13-4-2-1-3-5(14)6(4)7-8(15)10(17)12(19)11(18)9(7)16/h1-3H
InChIKey FGDPOTMRBQHPJK-UHFFFAOYSA-N
Molecular Weight 395.327 g/mol
SMILES c1cc(c(c(c1)Cl)-c1c(c(c(c(c1Cl)Cl)Cl)Cl)Cl)Cl
SPLASH splash10-01vp-3936000000-bc1bdb5715204fccb570
Source of Spectrum W5-1989-15299-1
Wiley ID 1365522