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Ethyl 4-(dimethylaminomethyl)-5-hydroxy-2-(pyridin-2-ylsulfanylmethyl)-1-benzofuran-3-carboxylate
SpectraBase Compound ID Hh4XiE1EqcQ
InChI InChI=1S/C20H22N2O4S/c1-4-25-20(24)19-16(12-27-17-7-5-6-10-21-17)26-15-9-8-14(23)13(18(15)19)11-22(2)3/h5-10,23H,4,11-12H2,1-3H3
InChIKey BWZNBLSTJQOOFX-UHFFFAOYSA-N
Mol Weight 386.47 g/mol
Molecular Formula C20H22N2O4S
Exact Mass 386.130028 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3mCVIe1OUZe
Name Ethyl 4-(dimethylaminomethyl)-5-hydroxy-2-(pyridin-2-ylsulfanylmethyl)-1-benzofuran-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22N2O4S
InChI InChI=1S/C20H22N2O4S/c1-4-25-20(24)19-16(12-27-17-7-5-6-10-21-17)26-15-9-8-14(23)13(18(15)19)11-22(2)3/h5-10,23H,4,11-12H2,1-3H3
InChIKey BWZNBLSTJQOOFX-UHFFFAOYSA-N
Molecular Weight 386.466 g/mol
SMILES Oc1c(c2c(c(oc2cc1)CSc1ncccc1)C(=O)OCC)CN(C)C
SPLASH splash10-01p7-9350000000-21508364d2ce8eb422ac
Synonyms 4-[(dimethylamino)methyl]-5-hydroxy-2-[(2-pyridinylthio)methyl]-3-benzofurancarboxylic acid ethyl ester Ethyl 4-[(dimethylamino)methyl]-5-hydroxy-2-(pyridin-2-ylsulfanylmethyl)-1-benzofuran-3-carboxylate Ethyl 4-[(dimethylamino)methyl]-5-hydroxy-2-(2-pyridylsulfanylmethyl)benzofuran-3-carboxylate Ethyl 4-[(dimethylamino)methyl]-5-oxidanyl-2-(pyridin-2-ylsulfanylmethyl)-1-benzofuran-3-carboxylate
Wiley ID 1442347