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2-Oxo-2H-thieno(2,3-H)(1)-benzopyran-3-thiocarboxamide
SpectraBase Compound ID KM7TFKF7eKr
InChI InChI=1S/C12H7NO2S2/c13-11(16)8-5-6-1-2-9-7(3-4-17-9)10(6)15-12(8)14/h1-5H,(H2,13,16)
InChIKey YRQYBCASGURHBV-UHFFFAOYSA-N
Mol Weight 261.31 g/mol
Molecular Formula C12H7NO2S2
Exact Mass 260.991821 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Aaap39rQ10k
Name 2-Oxo-2H-thieno(2,3-H)(1)-benzopyran-3-thiocarboxamide
CAS Registry Number 82861-44-7
Comments reassigned
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H7NO2S2
InChI InChI=1S/C12H7NO2S2/c13-11(16)8-5-6-1-2-9-7(3-4-17-9)10(6)15-12(8)14/h1-5H,(H2,13,16)
InChIKey YRQYBCASGURHBV-UHFFFAOYSA-N
Instrument Name Jeol FX-90
Literature Reference N.M. Brown, A. De, J.S. Brunskill, Org. Magn. Resonance 18, 211 (1982).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6