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ISOBIFLORIN;5,7-DIHYDROXY-2-METHYLCHROMONE-8-C-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID BCj70Kw5Kr9
InChI InChI=1S/C16H18O9/c1-5-2-6(18)10-7(19)3-8(20)11(15(10)24-5)16-14(23)13(22)12(21)9(4-17)25-16/h2-3,9,12-14,16-17,19-23H,4H2,1H3/t9-,12-,13+,14-,16+/m1/s1
InChIKey UDTUCCXZNVRBEJ-PBVFJORSSA-N
Mol Weight 354.31 g/mol
Molecular Formula C16H18O9
Exact Mass 354.095082 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 51RlobVfCqi
Name ISOBIFLORIN;5,7-DIHYDROXY-2-METHYLCHROMONE-8-C-BETA-D-GLUCOPYRANOSIDE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H18O9
InChI InChI=1S/C16H18O9/c1-5-2-6(18)10-7(19)3-8(20)11(15(10)24-5)16-14(23)13(22)12(21)9(4-17)25-16/h2-3,9,12-14,16-17,19-23H,4H2,1H3/t9-,12-,13+,14-,16+/m1/s1
InChIKey UDTUCCXZNVRBEJ-PBVFJORSSA-N
Literature Reference Author Y.ZHANG,Y.CHEN
Literature Reference Citation PHYTOCHEM.,45,401(1997)
Literature Reference DOI 10.1016/S0031-9422(96)00836-9
Molecular Weight 354.314 g/mol
Solvent DMSO-D6
Source File Reference UWSP1384