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Ethyl 2-(m,p-Dichloro-o-methoxycarbonylmethylphenyl)-2-(phenylsulfonyl)acetate
SpectraBase Compound ID 6iwudYcqGL1
InChI InChI=1S/C19H18Cl2O6S/c1-3-27-19(23)18(28(24,25)13-7-5-4-6-8-13)14-11-16(21)15(20)9-12(14)10-17(22)26-2/h4-9,11,18H,3,10H2,1-2H3
InChIKey XKIATHYNTLOQJX-UHFFFAOYSA-N
Mol Weight 445.31 g/mol
Molecular Formula C19H18Cl2O6S
Exact Mass 444.020115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DtMkw9tu8va
Name Ethyl 2-(m,p-Dichloro-o-methoxycarbonylmethylphenyl)-2-(phenylsulfonyl)acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18Cl2O6S
InChI InChI=1S/C19H18Cl2O6S/c1-3-27-19(23)18(28(24,25)13-7-5-4-6-8-13)14-11-16(21)15(20)9-12(14)10-17(22)26-2/h4-9,11,18H,3,10H2,1-2H3
InChIKey XKIATHYNTLOQJX-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol703058p
Molecular Weight 445.313 g/mol
SMILES c1(cc(CC(OC)=O)c(cc1Cl)C(C(OCC)=O)S(=O)(=O)c1ccccc1)Cl
SPLASH splash10-0ufr-4449000000-011d87a0debc721b34a3
Source of Spectrum A1-10-693/SMS6-10
Synonyms Ethyl 2-(4,5-dichloro-2-(2-methoxy-2-oxoethyl)phenyl)-2-(phenylsulfonyl)acetate
Wiley ID 1759144