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(E)-1-phenyl-3-[2-(2,3,5,6-tetrachloro-4-hydroxy-phenoxy)-1,3-benzodioxol-5-yl]prop-2-en-1-one

View entire compound with spectra: 1 MS (GC)

(E)-1-phenyl-3-[2-(2,3,5,6-tetrachloro-4-hydroxy-phenoxy)-1,3-benzodioxol-5-yl]prop-2-en-1-one
SpectraBase Compound ID DchAgUmm9wo
InChI InChI=1S/C22H12Cl4O5/c23-16-18(25)21(19(26)17(24)20(16)28)31-22-29-14-9-7-11(10-15(14)30-22)6-8-13(27)12-4-2-1-3-5-12/h1-10,22,28H/b8-6+
InChIKey OBTHXHNEPSNDAV-SOFGYWHQSA-N
Mol Weight 498.1 g/mol
Molecular Formula C22H12Cl4O5
Exact Mass 495.943884 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3dlkkjsoNMi
Name (E)-1-phenyl-3-[2-(2,3,5,6-tetrachloro-4-hydroxy-phenoxy)-1,3-benzodioxol-5-yl]prop-2-en-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H12Cl4O5
InChI InChI=1S/C22H12Cl4O5/c23-16-18(25)21(19(26)17(24)20(16)28)31-22-29-14-9-7-11(10-15(14)30-22)6-8-13(27)12-4-2-1-3-5-12/h1-10,22,28H/b8-6+
InChIKey OBTHXHNEPSNDAV-SOFGYWHQSA-N
Molecular Weight 498.145 g/mol
SMILES Oc1c(c(c(c(c1Cl)Cl)OC1Oc2cc(\C=C\C(=O)c3ccccc3)ccc2O1)Cl)Cl
SPLASH splash10-0002-3490000000-a729c4e3eeda00f330d5
Source of Spectrum KC-0-2549-21
Synonyms (E)-1-phenyl-3-[2-(2,3,5,6-tetrachloro-4-hydroxyphenoxy)-1,3-benzodioxol-5-yl]-2-propen-1-one (E)-1-phenyl-3-[2-[2,3,5,6-tetrakis(chloranyl)-4-oxidanyl-phenoxy]-1,3-benzodioxol-5-yl]prop-2-en-1-one
Wiley ID 821562