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ETHYL-8-BROMO-2-OXO-2H-THIENO-[2,3-H]-[1]-BENZOPYRAN-3-CARBOXYLATE
SpectraBase Compound ID FNM6guD6rYS
InChI InChI=1S/C14H9BrO4S/c1-2-18-13(16)9-5-7-3-4-10-8(6-11(15)20-10)12(7)19-14(9)17/h3-6H,2H2,1H3
InChIKey XIQGNEOECJDFFD-UHFFFAOYSA-N
Mol Weight 353.19 g/mol
Molecular Formula C14H9BrO4S
Exact Mass 351.940493 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID r5tLnZFgxq
Name 8-Bromo-2-oxo-2H-thieno(2,3-H)(1)-benzopyran-3-carboxylic acid, ethyl ester
CAS Registry Number 73709-18-9
Comments reassigned
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H9BrO4S
InChI InChI=1S/C14H9BrO4S/c1-2-18-13(16)9-5-7-3-4-10-8(6-11(15)20-10)12(7)19-14(9)17/h3-6H,2H2,1H3
InChIKey XIQGNEOECJDFFD-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