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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 7wwdDKZApN3
Name PELARGONIDIN_3-O-BETA-D-GLUCOSIDE
Compound Number 1
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 K.HOSOKAWA,Y.FUKUNAGA,E.FUKUSHI,J.KAWABATA
Literature Reference Citation PHYTOCHEM.,39,1437(1995)
Literature Reference DOI 10.1016/0031-9422(95)00140-3
Molecular Weight 433.392 g/mol
Solvent CD3OD:TFA-D=9:1
Source File Reference UWMZ7859