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QZDDHLKGAQQTLO-UHFFFAOYSA-N
SpectraBase Compound ID 4AQz3ZU4JPu
InChI InChI=1S/C16H21BrO4/c1-15(2,20)5-4-6-16(3)9-13(19)10-7-12(18)11(17)8-14(10)21-16/h7-8,18,20H,4-6,9H2,1-3H3
InChIKey QZDDHLKGAQQTLO-UHFFFAOYSA-N
Mol Weight 357.24 g/mol
Molecular Formula C16H21BrO4
Exact Mass 356.062322 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4gnZkEBKKrB
Name 7-HYDROXY-CYMOPOCHROMANONE;PBQ1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H21BrO4
InChI InChI=1S/C16H21BrO4/c1-15(2,20)5-4-6-16(3)9-13(19)10-7-12(18)11(17)8-14(10)21-16/h7-8,18,20H,4-6,9H2,1-3H3
InChIKey QZDDHLKGAQQTLO-UHFFFAOYSA-N
Literature Reference Author S.BADAL,W.GALLIMORE,G.HUANG,T.R.J.TZENG,R.DELGODA
Literature Reference Citation ORG.MED.CHEM.LETT.,2,21(2012)
Literature Reference DOI 10.1186/2191-2858-2-21
Molecular Weight 357.244 g/mol
Solvent CDCl3
Source File Reference UWLU976371