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2-[4-[4,5-bis(2-keto-2-methoxy-ethoxy)-2-methyl-phenyl]-2-(2-keto-2-methoxy-ethoxy)-5-methyl-phenoxy]acetic acid methyl ester
SpectraBase Compound ID 1doe7kkbCnM
InChI InChI=1S/C26H30O12/c1-15-7-19(35-11-23(27)31-3)21(37-13-25(29)33-5)9-17(15)18-10-22(38-14-26(30)34-6)20(8-16(18)2)36-12-24(28)32-4/h7-10H,11-14H2,1-6H3
InChIKey VHBJDIAMYLOUOD-UHFFFAOYSA-N
Mol Weight 534.51 g/mol
Molecular Formula C26H30O12
Exact Mass 534.173726 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5RmxaNHdngU
Name 2-[4-[4,5-bis(2-keto-2-methoxy-ethoxy)-2-methyl-phenyl]-2-(2-keto-2-methoxy-ethoxy)-5-methyl-phenoxy]acetic acid methyl ester
Alternate Name(s) 2-[4-[4,5-bis(2-methoxy-2-oxoethoxy)-2-methylphenyl]-2-(2-methoxy-2-oxoethoxy)-5-methylphenoxy]acetic acid methyl ester methyl 2-[4-[4,5-bis(2-methoxy-2-oxidanylidene-ethoxy)-2-methyl-phenyl]-2-(2-methoxy-2-oxidanylidene-ethoxy)-5-methyl-phenoxy]ethanoate methyl 2-[4-[4,5-bis(2-methoxy-2-oxo-ethoxy)-2-methyl-phenyl]-2-(2-methoxy-2-oxo-ethoxy)-5-methyl-phenoxy]acetate
Comments Less than 3 mono-isotopic peaks
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Formula C26H30O12
InChI InChI=1S/C26H30O12/c1-15-7-19(35-11-23(27)31-3)21(37-13-25(29)33-5)9-17(15)18-10-22(38-14-26(30)34-6)20(8-16(18)2)36-12-24(28)32-4/h7-10H,11-14H2,1-6H3
InChIKey VHBJDIAMYLOUOD-UHFFFAOYSA-N
Molecular Weight 534.514 g/mol
SMILES C(COc1cc(c(cc1OCC(=O)OC)C)-c1cc(c(cc1C)OCC(=O)OC)OCC(=O)OC)(=O)OC
SPLASH splash10-001i-0000090000-c9b582469f9d1b2b3d6f
Source of Spectrum C5-2003-94-2
Wiley ID 1615237