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Benzoic acid, 2-[[2-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-4-ethoxy-3,4-dioxo-1-butenyl]thio]-, methyl ester
SpectraBase Compound ID CclkGbGa70s
InChI InChI=1S/C20H28O6SSi/c1-8-25-19(23)17(21)15(26-28(6,7)20(2,3)4)13-27-16-12-10-9-11-14(16)18(22)24-5/h9-13H,8H2,1-7H3/b15-13+
InChIKey NVFCWCBIPNWSCX-FYWRMAATSA-N
Mol Weight 424.58 g/mol
Molecular Formula C20H28O6SSi
Exact Mass 424.137586 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BI4sZa0rS5h
Name Benzoic acid, 2-[[2-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-4-ethoxy-3,4-dioxo-1-butenyl]thio]-, methyl ester
CAS Registry Number 131327-64-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28O6SSi
InChI InChI=1S/C20H28O6SSi/c1-8-25-19(23)17(21)15(26-28(6,7)20(2,3)4)13-27-16-12-10-9-11-14(16)18(22)24-5/h9-13H,8H2,1-7H3/b15-13+
InChIKey NVFCWCBIPNWSCX-FYWRMAATSA-N
Molecular Weight 424.583 g/mol
SMILES C(\C(O[Si](C(C)(C)C)(C)C)=C/Sc1c(C(=O)OC)cccc1)(C(=O)OCC)=O
SPLASH splash10-014r-3829000000-48b2f26f494ac66d2ae5
Source of Spectrum F-46-6541-0
Synonyms Ethyl 3-(t-brtyldimethylsiloxy)-4-[(2-methoxycarbonylpheny)thio]-2-oxobut-3-enoate Methyl 2-[((1E)-2-{[tert-butyl(dimethyl)silyl]oxy}-4-ethoxy-3,4-dioxo-1-butenyl)sulfanyl]benzoate
Wiley ID 1379192