For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Bergenin monohydrate
SpectraBase Compound ID CDWIz8dZSH3
InChI InChI=1S/C14H16O9.O/c1-21-11-5(16)2-4-7(9(11)18)12-13(23-14(4)20)10(19)8(17)6(3-15)22-12;/h2,6,8,10,12-13,15-19H,3H2,1H3;/t6-,8-,10+,12+,13-;/m1./s1
InChIKey WURCMNTZJJZJNH-YOKSUNLASA-N
Mol Weight 344.27 g/mol
Molecular Formula C14H16O10
Exact Mass 344.074347 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 5bKDEKoyfxr
Name Bergenin monohydrate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 346667
CAS Registry Number 108032-11-7
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O10
InChI InChI=1S/C14H16O9.O/c1-21-11-5(16)2-4-7(9(11)18)12-13(23-14(4)20)10(19)8(17)6(3-15)22-12;/h2,6,8,10,12-13,15-19H,3H2,1H3;/t6-,8-,10+,12+,13-;/m1./s1
InChIKey WURCMNTZJJZJNH-YOKSUNLASA-N
Observed nucleus 1H
Purity 98%
Solvent DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms (2R,3S,4S,4aR,10bS)-3,4,8,10-tetrahydroxy-2-(hydroxymethyl)-9-methoxy-3,4,4a,10b-tetrahydro-2H-pyrano[3,2-c]isochromen-6-one hydrate
Wiley ID SIAL_1HNMR_007171