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3-[(Carboxymethyl)thio]-2,5-thiophenedicarboxylic acid
SpectraBase Compound ID IfdxlqSqs6s
InChI InChI=1S/C8H6O6S2/c9-5(10)2-15-3-1-4(7(11)12)16-6(3)8(13)14/h1H,2H2,(H,9,10)(H,11,12)(H,13,14)
InChIKey KHACJJCVQBNVCI-UHFFFAOYSA-N
Mol Weight 262.25 g/mol
Molecular Formula C8H6O6S2
Exact Mass 261.96058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2wZXeDu8jlY
Name 3-[(Carboxymethyl)thio]-2,5-thiophenedicarboxylic acid
Alternate Name(s) 3-[(carboxymethyl)sulfanyl]-2,5-thiophenedicarboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H6O6S2
InChI InChI=1S/C8H6O6S2/c9-5(10)2-15-3-1-4(7(11)12)16-6(3)8(13)14/h1H,2H2,(H,9,10)(H,11,12)(H,13,14)
InChIKey KHACJJCVQBNVCI-UHFFFAOYSA-N
Molecular Weight 262.250 g/mol
SMILES OC(c1sc(c(SCC(=O)O)c1)C(=O)O)=O
SPLASH splash10-0002-8090000000-15a6df238062beffc90a
Source of Spectrum F4-0-3858-5
Wiley ID 1621044