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Ethyl 2,3,4-trimethoxymandelate
SpectraBase Compound ID 8177eaXoOL9
InChI InChI=1S/C13H18O6/c1-5-19-13(15)10(14)8-6-7-9(16-2)12(18-4)11(8)17-3/h6-7,10,14H,5H2,1-4H3
InChIKey LNEKOCOWHRAAFB-UHFFFAOYSA-N
Mol Weight 270.28 g/mol
Molecular Formula C13H18O6
Exact Mass 270.110338 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DOiH8RAJDEp
Name Ethyl 2,3,4-trimethoxymandelate
Alternate Name(s) Ethyl hydroxy(2,3,4-trimethoxyphenyl)acetate Ethyl 2-hydroxy-2-(2,3,4-trimethoxyphenyl)acetate Ethyl 2-oxidanyl-2-(2,3,4-trimethoxyphenyl)ethanoate
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Formula C13H18O6
InChI InChI=1S/C13H18O6/c1-5-19-13(15)10(14)8-6-7-9(16-2)12(18-4)11(8)17-3/h6-7,10,14H,5H2,1-4H3
InChIKey LNEKOCOWHRAAFB-UHFFFAOYSA-N
Molecular Weight 270.281 g/mol
SMILES OC(C(=O)OCC)c1c(c(c(cc1)OC)OC)OC
SPLASH splash10-0002-0900000000-a8f47f33708a7224eb24
Source of Spectrum F4-0-2107-3
Wiley ID 1620042