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4-({[(3-carboxy-5-methyl-2-furyl)methyl]sulfanyl}methyl)-5-methyl-2-furoic acid
SpectraBase Compound ID 5ogQjHX6owU
InChI InChI=1S/C14H14O6S/c1-7-3-10(13(15)16)12(19-7)6-21-5-9-4-11(14(17)18)20-8(9)2/h3-4H,5-6H2,1-2H3,(H,15,16)(H,17,18)
InChIKey RXIUWANGZARSBV-UHFFFAOYSA-N
Mol Weight 310.32 g/mol
Molecular Formula C14H14O6S
Exact Mass 310.051109 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FzGWesTriPZ
Name 4-({[(3-carboxy-5-methyl-2-furyl)methyl]sulfanyl}methyl)-5-methyl-2-furoic acid
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C14H14O6S/c1-7-3-10(13(15)16)12(19-7)6-21-5-9-4-11(14(17)18)20-8(9)2/h3-4H,5-6H2,1-2H3,(H,15,16)(H,17,18)
InChIKey RXIUWANGZARSBV-UHFFFAOYSA-N
NMR Offset 15.1316
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7000_1298
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: ZI/6013716; Labnumber: LP-23/204; IOH_ID: IOH-001299
Temperature 323 °C