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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 Jx15rhp3FFy
Name METHYL-2-OXO-2H-THIENO-[2,3-H]-[1]-BENZOPYRAN-3-CARBOXYLATE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. 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
Literature Reference Author N.M.D.BROWN,A.DE,J.S.A.BRUNSKILL,H.JEFFREY
Literature Reference Citation ORG.MAGN.RES.,18,211(1982)
Literature Reference DOI 10.1002/mrc.1270180408
Molecular Weight 260.264 g/mol
Solvent DMSO-D6
Source File Reference UWCS10955