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2,5-Dihydroxy-2-methyl-3H-benzofuran-3,4-dicarboxylic acid O3-ethyl ester O4-methyl ester
SpectraBase Compound ID CJ6dynURsoa
InChI InChI=1S/C14H16O7/c1-4-20-13(17)11-10-8(21-14(11,2)18)6-5-7(15)9(10)12(16)19-3/h5-6,11,15,18H,4H2,1-3H3
InChIKey IRAQZYYMMPTTRG-UHFFFAOYSA-N
Mol Weight 296.27 g/mol
Molecular Formula C14H16O7
Exact Mass 296.089603 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1gTgYiMNYNx
Name 2,5-Dihydroxy-2-methyl-3H-benzofuran-3,4-dicarboxylic acid O3-ethyl ester O4-methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O7
InChI InChI=1S/C14H16O7/c1-4-20-13(17)11-10-8(21-14(11,2)18)6-5-7(15)9(10)12(16)19-3/h5-6,11,15,18H,4H2,1-3H3
InChIKey IRAQZYYMMPTTRG-UHFFFAOYSA-N
Molecular Weight 296.275 g/mol
SMILES Oc1ccc2c(C(C(O2)(O)C)C(=O)OCC)c1C(=O)OC
SPLASH splash10-002f-9450000000-bb63a9d3ec120a8c2459
Synonyms 2,5-Dihydroxy-2-methyl-coumaran-3,4-dicarboxylic acid O3-ethyl ester O4-methyl ester 3-Ethyl 4-methyl 2,5-dihydroxy-2-methyl-2,3-dihydro-1-benzofuran-3,4-dicarboxylate 3-O-ethyl 4-O-methyl 2,5-dihydroxy-2-methyl-3H-1-benzofuran-3,4-dicarboxylate Benzo[b]furan-3,4-dicarboxylic acid, 2,3-dihydro, 4-methyl-2,5-dihydroxy-, 3-ethyl-, 2-methyl ester O3-ethyl O4-methyl 2,5-dihydroxy-2-methyl-3H-benzofuran-3,4-dicarboxylate O3-ethyl O4-methyl 2-methyl-2,5-bis(oxidanyl)-3H-1-benzofuran-3,4-dicarboxylate
Wiley ID 1478306