For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
5-[(4-carbethoxy-3-hydroxy-5-methyl-2-thienyl)-(4-fluorophenyl)methyl]-4-hydroxy-2-methyl-thiophene-3-carboxylic acid ethyl ester
SpectraBase Compound ID BoVVMYtU0gK
InChI InChI=1S/C23H23FO6S2/c1-5-29-22(27)15-11(3)31-20(18(15)25)17(13-7-9-14(24)10-8-13)21-19(26)16(12(4)32-21)23(28)30-6-2/h7-10,17,25-26H,5-6H2,1-4H3
InChIKey XKIPBQVXFDPOIF-UHFFFAOYSA-N
Mol Weight 478.55 g/mol
Molecular Formula C23H23FO6S2
Exact Mass 478.092009 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID IPzhy4Oltet
Name 5-[(4-carbethoxy-3-hydroxy-5-methyl-2-thienyl)-(4-fluorophenyl)methyl]-4-hydroxy-2-methyl-thiophene-3-carboxylic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H23FO6S2
InChI InChI=1S/C23H23FO6S2/c1-5-29-22(27)15-11(3)31-20(18(15)25)17(13-7-9-14(24)10-8-13)21-19(26)16(12(4)32-21)23(28)30-6-2/h7-10,17,25-26H,5-6H2,1-4H3
InChIKey XKIPBQVXFDPOIF-UHFFFAOYSA-N
Molecular Weight 478.549 g/mol
SMILES Oc1c(C(c2sc(c(c2O)C(=O)OCC)C)c2ccc(cc2)F)sc(c1C(=O)OCC)C
SPLASH splash10-0007-4890000000-6d89b945396c37df14e2
Synonyms 5-[(4-ethoxycarbonyl-3-hydroxy-5-methyl-2-thiophenyl)-(4-fluorophenyl)methyl]-4-hydroxy-2-methyl-3-thiophenecarboxylic acid ethyl ester Ethyl 5-[(4-ethoxycarbonyl-3-hydroxy-5-methyl-2-thienyl)-(4-fluorophenyl)methyl]-4-hydroxy-2-methyl-thiophene-3-carboxylate Ethyl 5-[(4-ethoxycarbonyl-3-hydroxy-5-methylthiophen-2-yl)-(4-fluorophenyl)methyl]-4-hydroxy-2-methylthiophene-3-carboxylate Ethyl 5-[(4-ethoxycarbonyl-5-methyl-3-oxidanyl-thiophen-2-yl)-(4-fluorophenyl)methyl]-2-methyl-4-oxidanyl-thiophene-3-carboxylate
Wiley ID 1512407