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Heptachlorobiphenyl
SpectraBase Compound ID E6tRfibGy36
InChI InChI=1S/C12H3Cl7/c13-5-2-7(15)6(14)1-4(5)10-8(16)3-9(17)11(18)12(10)19/h1-3H
InChIKey KQBFUDNJKCZEDQ-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 3vfnEpFmTmJ
Name Heptachlorobiphenyl
CAS Registry Number 28655-71-2
Classification Chemical Heat transfer agent
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Exact Mass 391.805443997 u
Formula C12H3Cl7
InChI InChI=1S/C12H3Cl7/c13-5-2-7(15)6(14)1-4(5)10-8(16)3-9(17)11(18)12(10)19/h1-3H
InChIKey KQBFUDNJKCZEDQ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 395.327 g/mol
SMILES c1c(c(c(Cl)c(c1Cl)-c1c(cc(c(Cl)c1)Cl)Cl)Cl)Cl
SPLASH splash10-006w-2319000000-06c3614d8ee7f1e03b66
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms 2,2',3,4,4',5,5'-Heptachlorobiphenyl Polychlorinated biphenyl (7Cl)
Technique GC/MS
Wiley ID MMPW6e_885