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Phloroglucinol dihydrate

View entire compound with spectra: 3 NMR, 3 FTIR, and 1 UV-Vis

Phloroglucinol dihydrate
SpectraBase Compound ID LrWIUWQJSbA
InChI InChI=1S/C6H6O3.2H2O/c7-4-1-5(8)3-6(9)2-4;;/h1-3,7-9H;2*1H2
InChIKey MPYXTIHPALVENR-UHFFFAOYSA-N
Mol Weight 158.109 g/mol
Molecular Formula C6H6O5
Exact Mass 158.021523 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8fCYXpFjrt1
Name 1,3,5-Trihydroxybenzene dihydrate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number P38005
CAS Registry Number 6099-90-7
Copyright Copyright © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H6O5
InChI 1S/C6H6O3.2H2O/c7-4-1-5(8)3-6(9)2-4;;/h1-3,7-9H;2*1H2
InChIKey MPYXTIHPALVENR-UHFFFAOYSA-N
Observed nucleus 1H
Purity 97%
Solvent CDCl3 & DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms Phloroglucinol dihydrate
Wiley ID SIAL_1HNMR_012535