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{{[(2-oxotetrahydro-3-thienyl)carbamoyl]methyl}thio}acetic acid
SpectraBase Compound ID DfESn50Bhr3
InChI InChI=1S/C8H11NO4S2/c10-6(3-14-4-7(11)12)9-5-1-2-15-8(5)13/h5H,1-4H2,(H,9,10)(H,11,12)
InChIKey QGFORSXNKQLDNO-UHFFFAOYSA-N
Mol Weight 249.3 g/mol
Molecular Formula C8H11NO4S2
Exact Mass 249.01295 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EldZHDavBrj
Name {{[(2-OXOTETRAHYDRO-3-THIENYL)CARBAMOYLMETHYL}THIO}ACETIC ACID
Source of Sample G. Vandoni and M. Gobetti, Edmond Pharma S.R.L., Milan, Italy
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H11NO4S2
InChI InChI=1S/C8H11NO4S2/c10-6(3-14-4-7(11)12)9-5-1-2-15-8(5)13/h5H,1-4H2,(H,9,10)(H,11,12)
InChIKey QGFORSXNKQLDNO-UHFFFAOYSA-N
Molecular Weight 249.31
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms ACETIC ACID, ////2-OXOTETRAHYDRO- 3-THIENYL/CARBAMOYL/METHYL/THIO/-,