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CALYCOSIN
SpectraBase Compound ID GE29DypXAfY
InChI InChI=1S/C16H12O5/c1-20-14-5-2-9(6-13(14)18)12-8-21-15-7-10(17)3-4-11(15)16(12)19/h2-8,17-18H,1H3
InChIKey ZZAJQOPSWWVMBI-UHFFFAOYSA-N
Mol Weight 284.27 g/mol
Molecular Formula C16H12O5
Exact Mass 284.068473 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GAaMDhDvJKC
Name CALYCOSIN;7,3'-DIHYDROXY-4'-METHOXY-ISOFLAVONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H12O5
InChI InChI=1S/C16H12O5/c1-20-14-5-2-9(6-13(14)18)12-8-21-15-7-10(17)3-4-11(15)16(12)19/h2-8,17-18H,1H3
InChIKey ZZAJQOPSWWVMBI-UHFFFAOYSA-N
Literature Reference Author X.DU,Y.BAI,H.LIANG,Z.WANG,Y.ZHAO,Q.ZHANG,L.HUANG
Literature Reference Citation MAGN.RES.CHEM.,44,708(2006)
Literature Reference DOI 10.1002/mrc.1806
Molecular Weight 284.268 g/mol
Sample ID 40811
Solvent DMSO-D6