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WTNBLXZKPNJCPH-UHFFFAOYSA-N
SpectraBase Compound ID LFGUGaUfy14
InChI InChI=1S/C13H8O4S/c1-16-12(14)9-6-7-2-3-10-8(4-5-18-10)11(7)17-13(9)15/h2-6H,1H3
InChIKey WTNBLXZKPNJCPH-UHFFFAOYSA-N
Mol Weight 260.26 g/mol
Molecular Formula C13H8O4S
Exact Mass 260.01433 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DwHdlwN92Aq
Name 2-Oxo-2H-thieno(2,3-H)(1)-benzopyran-3-carboxylic acid, methyl ester
CAS Registry Number 74458-97-2
Comments reassigned
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H8O4S
InChI InChI=1S/C13H8O4S/c1-16-12(14)9-6-7-2-3-10-8(4-5-18-10)11(7)17-13(9)15/h2-6H,1H3
InChIKey WTNBLXZKPNJCPH-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