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QTFGTZQVCBUPKY-HUZOTTPUSA-N
SpectraBase Compound ID BI5Q3YNrZtS
InChI InChI=1S/C18H16O6/c1-20-17(19)15-13-9-11-12-7-8-14(23-21-12)18(11,24-22-13)16(15)10-5-3-2-4-6-10/h2-9,12-16H,1H3/t12-,13+,14+,15-,16+,18+/m1/s1
InChIKey QTFGTZQVCBUPKY-HUZOTTPUSA-N
Mol Weight 328.32 g/mol
Molecular Formula C18H16O6
Exact Mass 328.094688 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LR4zOGwt0kc
Name QTFGTZQVCBUPKY-HUZOTTPUSA-N
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H16O6
InChI InChI=1S/C18H16O6/c1-20-17(19)15-13-9-11-12-7-8-14(23-21-12)18(11,24-22-13)16(15)10-5-3-2-4-6-10/h2-9,12-16H,1H3/t12-,13+,14+,15-,16+,18+/m1/s1
InChIKey QTFGTZQVCBUPKY-HUZOTTPUSA-N
Literature Reference Author G.TOTH,T.LINKER,F.REBIEN
Literature Reference Citation MAGN.RES.CHEM.,35,367(1997)
Literature Reference DOI 10.1002/(sici)1097-458x(199706)35:6<367::aid-omr95>3.0.co;2-v
Molecular Weight 328.321 g/mol
Solvent CDCl3
Source File Reference UWCP4503