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1-[2,5-dichloro-4-(4-chlorophenyl)-3-thienyl]-2,2-dimethylpropan-1-one
SpectraBase Compound ID 4zTRrvbOwTS
InChI InChI=1S/C15H13Cl3OS/c1-15(2,3)12(19)11-10(13(17)20-14(11)18)8-4-6-9(16)7-5-8/h4-7H,1-3H3
InChIKey JXKPEHOOBPXELR-UHFFFAOYSA-N
Mol Weight 347.69 g/mol
Molecular Formula C15H13Cl3OS
Exact Mass 345.975269 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5DTHAYo3qEK
Name 1-[2,5-dichloro-4-(4-chlorophenyl)-3-thienyl]-2,2-dimethylpropan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H13Cl3OS
InChI InChI=1S/C15H13Cl3OS/c1-15(2,3)12(19)11-10(13(17)20-14(11)18)8-4-6-9(16)7-5-8/h4-7H,1-3H3
InChIKey JXKPEHOOBPXELR-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol802513q
Molecular Weight 347.687 g/mol
SMILES C(C)(C)(C(c1c(c(sc1Cl)Cl)-c1ccc(cc1)Cl)=O)C
SPLASH splash10-03ec-0591000000-9f0067cca0776ab79564
Source of Spectrum A1-11-445/SM11-5g
Synonyms 1-(2,5-dichloro-4-(4-chlorophenyl)thiophen-3-yl)-2,2-dimethylpropan-1-one
Wiley ID 1756415