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FWYSBEAFFPBAQU-UHFFFAOYSA-N

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FWYSBEAFFPBAQU-UHFFFAOYSA-N
SpectraBase Compound ID DL54iLbjgqs
InChI InChI=1S/C14H14O4/c1-14(2,16)12-6-9-5-8-3-4-13(15)18-10(8)7-11(9)17-12/h3-5,7,12,16H,6H2,1-2H3
InChIKey FWYSBEAFFPBAQU-UHFFFAOYSA-N
Mol Weight 246.26 g/mol
Molecular Formula C14H14O4
Exact Mass 246.089209 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IebZ8D4JMfP
Name MARMESIN
Compound Number 182
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H14O4
InChI InChI=1S/C14H14O4/c1-14(2,16)12-6-9-5-8-3-4-13(15)18-10(8)7-11(9)17-12/h3-5,7,12,16H,6H2,1-2H3
InChIKey FWYSBEAFFPBAQU-UHFFFAOYSA-N
Literature Reference Author H.DUDDECK,M.KAISER
Literature Reference Citation ORG.MAGN.RES.,20,55(1982)
Literature Reference DOI 10.1002/mrc.1270200202
Molecular Weight 246.263 g/mol
Solvent DMSO
Source File Reference UNIW5771