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PELARGONIDIN_3-O-BETA-D-GLUCOSIDE
SpectraBase Compound ID 5V724phxSTq
InChI InChI=1S/C21H20O10/c22-8-16-17(26)18(27)19(28)21(31-16)30-15-7-12-13(25)5-11(24)6-14(12)29-20(15)9-1-3-10(23)4-2-9/h1-7,16-19,21-22,26-28H,8H2,(H2-,23,24,25)/p+1/t16-,17-,18+,19-,21-/m0/s1
InChIKey ABVCUBUIXWJYSE-UNJWAJPSSA-O
Mol Weight 433.39 g/mol
Molecular Formula C21H21O10
Exact Mass 433.113472 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2pcn4XEuzoa
Name PELARGONIDIN-3-O-BETA-GLUCOPYRANOSIDE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H21O10
InChI InChI=1S/C21H20O10/c22-8-16-17(26)18(27)19(28)21(31-16)30-15-7-12-13(25)5-11(24)6-14(12)29-20(15)9-1-3-10(23)4-2-9/h1-7,16-19,21-22,26-28H,8H2,(H2-,23,24,25)/p+1/t16-,17-,18+,19-,21-/m0/s1
InChIKey ABVCUBUIXWJYSE-UNJWAJPSSA-O
Literature Reference Author O.M.ANDERSEN,T.FOSSEN,K.TORSKANGERPOLL,A.FOSSEN,U.HAUGE
Literature Reference Citation PHYTOCHEM.,65,405(2004)
Literature Reference DOI 10.1016/j.phytochem.2003.10.014
Molecular Weight 433.392 g/mol
Solvent CF3CO2D:CD3OD=10:90
Source File Reference UWLU34588