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4-amino-5-(benzylthio)thiophene-2-carboxylic acid methyl ester
SpectraBase Compound ID 1JMmWFlhNm3
InChI InChI=1S/C13H13NO2S2/c1-16-12(15)11-7-10(14)13(18-11)17-8-9-5-3-2-4-6-9/h2-7H,8,14H2,1H3
InChIKey NKHMQQUVWCBIBV-UHFFFAOYSA-N
Mol Weight 279.37 g/mol
Molecular Formula C13H13NO2S2
Exact Mass 279.038771 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K2AxKYSQH1Y
Name 4-amino-5-(benzylthio)thiophene-2-carboxylic acid methyl ester
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H13NO2S2
InChI InChI=1S/C13H13NO2S2/c1-16-12(15)11-7-10(14)13(18-11)17-8-9-5-3-2-4-6-9/h2-7H,8,14H2,1H3
InChIKey NKHMQQUVWCBIBV-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2007)
Molecular Weight 279.372 g/mol
Source File Reference MHKO13326