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Ethanone, 1-[3-(3,5-dichloro-2,4-dihydroxy-6-methylbenzoyl)-2,4-dihydroxy-6-methoxyphenyl]-2,2,2-trifluoro-
SpectraBase Compound ID DhaJQPaJxOF
InChI InChI=1S/C17H11Cl2F3O7/c1-4-7(14(26)11(19)15(27)10(4)18)12(24)8-5(23)3-6(29-2)9(13(8)25)16(28)17(20,21)22/h3,23,25-27H,1-2H3
InChIKey JMEFJSBDWSHVJW-UHFFFAOYSA-N
Mol Weight 455.17 g/mol
Molecular Formula C17H11Cl2F3O7
Exact Mass 453.983393 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1sBZkssJmf
Name Ethanone, 1-[3-(3,5-dichloro-2,4-dihydroxy-6-methylbenzoyl)-2,4-dihydroxy-6-methoxyphenyl]-2,2,2-trifluoro-
CAS Registry Number 131086-56-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H11Cl2F3O7
InChI InChI=1S/C17H11Cl2F3O7/c1-4-7(14(26)11(19)15(27)10(4)18)12(24)8-5(23)3-6(29-2)9(13(8)25)16(28)17(20,21)22/h3,23,25-27H,1-2H3
InChIKey JMEFJSBDWSHVJW-UHFFFAOYSA-N
Molecular Weight 455.169 g/mol
SMILES Oc1cc(c(c(c1C(c1c(c(c(c(c1C)Cl)O)Cl)O)=O)O)C(C(F)(F)F)=O)OC
SPLASH splash10-0006-9101000000-40089611893a78c08555
Source of Spectrum B-43-1594-11
Synonyms 1-[3-(3,5-dichloro-2,4-dihydroxy-6-methylbenzoyl)-2,4-dihydroxy-6-methoxyphenyl]-2,2,2-trifluoroethanone 3,5-Dichloro-2,2',4,6'-tetrahydroxy-4'-methoxy-6-methyl-3'-trifluoroacetylbenzophenone
Wiley ID 1388589