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Ethyl 2-[(m-Methyl-o-methoxycarbonylmethyl)phenyl]-2-(phenylthio)acetate
SpectraBase Compound ID JF0f2sjsC13
InChI InChI=1S/C20H22O4S/c1-4-24-20(22)19(25-16-8-6-5-7-9-16)17-12-14(2)10-11-15(17)13-18(21)23-3/h5-12,19H,4,13H2,1-3H3
InChIKey BHJVKPQZLJGQJJ-UHFFFAOYSA-N
Mol Weight 358.45 g/mol
Molecular Formula C20H22O4S
Exact Mass 358.12388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7fzVUrjyY8
Name Ethyl 2-[(m-Methyl-o-methoxycarbonylmethyl)phenyl]-2-(phenylthio)acetate
Alternate Name(s) Ethyl 2-(2-(2-methoxy-2-oxoethyl)-5-methylphenyl)-2-(phenylthio)acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22O4S
InChI InChI=1S/C20H22O4S/c1-4-24-20(22)19(25-16-8-6-5-7-9-16)17-12-14(2)10-11-15(17)13-18(21)23-3/h5-12,19H,4,13H2,1-3H3
InChIKey BHJVKPQZLJGQJJ-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol703058p
Molecular Weight 358.452 g/mol
SMILES c1cc(CC(OC)=O)c(cc1C)C(Sc1ccccc1)C(=O)OCC
SPLASH splash10-01si-1921000000-bd73d67e270ad7eb4e82
Source of Spectrum A1-10-693/SMS3-5e
Wiley ID 1759152