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Berberine hydrochloride hydrate

View entire compound with spectra: 2 NMR, 2 FTIR, and 1 Raman

Berberine hydrochloride hydrate
SpectraBase Compound ID 5NmETyM3yhI
InChI InChI=1S/C20H18NO4.ClH.H2O/c1-22-17-4-3-12-7-16-14-9-19-18(24-11-25-19)8-13(14)5-6-21(16)10-15(12)20(17)23-2;;/h3-4,7-10H,5-6,11H2,1-2H3;1H;1H2/q+1;;/p-1
InChIKey BPNJXFPOPCFZOC-UHFFFAOYSA-M
Mol Weight 389.84 g/mol
Molecular Formula C20H20ClNO5
Exact Mass 389.103 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5zNqZPI5vjt
Name Berberine hydrochloride hydrate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 219088
CAS Registry Number 141433-60-5
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20ClNO5
InChI InChI=1S/C20H18NO4.ClH.H2O/c1-22-17-4-3-12-7-16-14-9-19-18(24-11-25-19)8-13(14)5-6-21(16)10-15(12)20(17)23-2;;/h3-4,7-10H,5-6,11H2,1-2H3;1H;1H2/q+1;;/p-1
InChIKey BPNJXFPOPCFZOC-UHFFFAOYSA-M
Observed nucleus 1H
Purity 99%
Solvent CDCl3 & DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_1HNMR_003144