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Phlorizin dihydrate (from Apple Wood)
SpectraBase Compound ID DGd09KmrA4v
InChI InChI=1S/C21H24O10.2H2O/c22-9-16-18(27)19(28)20(29)21(31-16)30-15-8-12(24)7-14(26)17(15)13(25)6-3-10-1-4-11(23)5-2-10;;/h1-2,4-5,7-8,16,18-24,26-29H,3,6,9H2;2*1H2/t16-,18-,19+,20-,21-;;/m1../s1
InChIKey XQWBNXSENPTIDY-YXMARJSJSA-N
Mol Weight 472.44 g/mol
Molecular Formula C21H28O12
Exact Mass 472.158076 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7cMq47UMEAF
Name Phloridzin dihydrate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 274313
CAS Registry Number 7061-54-3
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H28O12
InChI InChI=1S/C21H24O10.2H2O/c22-9-16-18(27)19(28)20(29)21(31-16)30-15-8-12(24)7-14(26)17(15)13(25)6-3-10-1-4-11(23)5-2-10;;/h1-2,4-5,7-8,16,18-24,26-29H,3,6,9H2;2*1H2/t16-,18-,19+,20-,21-;;/m1../s1
InChIKey XQWBNXSENPTIDY-YXMARJSJSA-N
Observed nucleus 1H
Purity 99%
Solvent DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 1-[2-(beta-D-Glucopyranosyloxy)-4,6-dihydroxyphenyl]-3-(4-hydroxyphenyl)-1-propanone Phloretin 2'-beta-D-glucopyranoside Phloretin 2'-beta-D-glucoside Phlorizin dihydrate
Wiley ID SIAL_1HNMR_004972