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3-(3,4,5-Trimethoxybenzyl)-5-ethyl-2-furoic acid
SpectraBase Compound ID FUziUxZa9Za
InChI InChI=1S/C17H20O6/c1-5-12-9-11(15(23-12)17(18)19)6-10-7-13(20-2)16(22-4)14(8-10)21-3/h7-9H,5-6H2,1-4H3,(H,18,19)
InChIKey LGAORDVYJDCYIC-UHFFFAOYSA-N
Mol Weight 320.34 g/mol
Molecular Formula C17H20O6
Exact Mass 320.125988 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H8UbHPftnuS
Name 3-(3,4,5-Trimethoxybenzyl)-5-ethyl-2-furoic acid
Alternate Name(s) 5-Ethyl-3-(3,4,5-trimethoxybenzyl)furan-2-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20O6
InChI InChI=1S/C17H20O6/c1-5-12-9-11(15(23-12)17(18)19)6-10-7-13(20-2)16(22-4)14(8-10)21-3/h7-9H,5-6H2,1-4H3,(H,18,19)
InChIKey LGAORDVYJDCYIC-UHFFFAOYSA-N
Literature Reference DOI 10.1002_(SICI)1099-0739(199606)10_5_389
Molecular Weight 320.341 g/mol
SMILES OC(=O)c1c(Cc2cc(c(c(c2)OC)OC)OC)cc(o1)CC
SPLASH splash10-004i-4920000000-3600fb59b17a7e66490e
Source of Spectrum AOC-10-392-9b
Wiley ID 1798929