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Pentachloroisupredioxin
SpectraBase Compound ID Fz0sGHaQOyi
InChI InChI=1S/C12H5Cl5O2/c13-5-1-3-7(11(16)9(5)14)19-8-4-2-6(18)10(15)12(8)17/h1-4,18H
InChIKey UVPMKPJPMQCYPX-UHFFFAOYSA-N
Mol Weight 358.4 g/mol
Molecular Formula C12H5Cl5O2
Exact Mass 355.873218 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4RVA0x6fyqF
Name Pentachloroisupredioxin
Alternate Name(s) 2,3-Dichloro-4-(2,3,4-trichlorophenoxy)phenol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H5Cl5O2
InChI InChI=1S/C12H5Cl5O2/c13-5-1-3-7(11(16)9(5)14)19-8-4-2-6(18)10(15)12(8)17/h1-4,18H
InChIKey UVPMKPJPMQCYPX-UHFFFAOYSA-N
Molecular Weight 358.435 g/mol
SMILES Oc1ccc(c(c1Cl)Cl)Oc1c(c(c(Cl)cc1)Cl)Cl
SPLASH splash10-052f-0009000000-47b32502a12f355d0b93
Source of Spectrum JC-89-330-2
Wiley ID 1345476