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Pentachloropredioxin
SpectraBase Compound ID HtIVlA3JgMs
InChI InChI=1S/C12H5Cl5O2/c13-5-2-1-3-8(9(5)15)19-12-7(18)4-6(14)10(16)11(12)17/h1-4,18H
InChIKey UVSPFRWWDPUFBO-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 6EGPUF8BPh9
Name Pentachloropredioxin
Alternate Name(s) 3,4,5-trichloro-2-(2,3-dichlorophenoxy)phenol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H5Cl5O2
InChI InChI=1S/C12H5Cl5O2/c13-5-2-1-3-8(9(5)15)19-12-7(18)4-6(14)10(16)11(12)17/h1-4,18H
InChIKey UVSPFRWWDPUFBO-UHFFFAOYSA-N
Molecular Weight 358.435 g/mol
SMILES Oc1c(c(c(Cl)c(c1)Cl)Cl)Oc1c(c(Cl)ccc1)Cl
SPLASH splash10-0a4i-0009000000-2636c295a6837afeffe0
Source of Spectrum JC-89-330-2
Wiley ID 1345477