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1,2,3,4,6,7,9-Heptachlorodibenzo-p-dioxin
SpectraBase Compound ID 3ibpzeykdSc
InChI InChI=1S/C12HCl7O2/c13-2-1-3(14)9-10(4(2)15)21-12-8(19)6(17)5(16)7(18)11(12)20-9/h1H
InChIKey KTJJIBIRZGQFQZ-UHFFFAOYSA-N
Mol Weight 425.3 g/mol
Molecular Formula C12HCl7O2
Exact Mass 421.779623 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6sahchgu8bZ
Name 1,2,3,4,6,7,9-Heptachlorodibenzo-p-dioxin
CAS Registry Number 58200-70-7
Comments Removed - expert review - solvent impurities
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12HCl7O2
InChI InChI=1S/C12HCl7O2/c13-2-1-3(14)9-10(4(2)15)21-12-8(19)6(17)5(16)7(18)11(12)20-9/h1H
InChIKey KTJJIBIRZGQFQZ-UHFFFAOYSA-N
Molecular Weight 425.309 g/mol
SMILES c12c(Oc3c(O2)c(c(cc3Cl)Cl)Cl)c(Cl)c(c(c1Cl)Cl)Cl
SPLASH splash10-00b9-0001900000-3286856292cea4249331
Source of Spectrum J-41-2437-0
Synonyms 1,2,3,4,6,7,9-Heptachlorodibenzo-para-dioxin 1,2,3,4,6,7,9-Heptachlorodibenzodioxin 1,2,3,4,6,7,9-heptakis(chloranyl)dibenzo-p-dioxin Dibenzo(b,E)(1,4)dioxin, 1,2,3,4,6,7,9-heptachloro- Dibenzo-p-dioxin, 1,2,3,4,6,7,9-heptachloro- BRN 1630270
Wiley ID 1378416