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2',4',6'-Trihydroxyacetophenone monohydrate
SpectraBase Compound ID 3btdJThkCFr
InChI InChI=1S/C8H8O4.O/c1-4(9)8-6(11)2-5(10)3-7(8)12;/h2-3,10-12H,1H3;
InChIKey YCXJOOWNSTXQLP-UHFFFAOYSA-N
Mol Weight 184.15 g/mol
Molecular Formula C8H8O5
Exact Mass 184.037173 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KekUZw3HAoq
Name 2',4',6'-Trihydroxyacetophenone monohydrate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number T64602
CAS Registry Number 480-66-0
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H8O5
InChI InChI=1S/C8H8O4.O/c1-4(9)8-6(11)2-5(10)3-7(8)12;/h2-3,10-12H,1H3;
InChIKey YCXJOOWNSTXQLP-UHFFFAOYSA-N
Observed nucleus 1H
Purity 98%
Solvent CDCl3 & DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 2-Acetylphloroglucinol THAP
Wiley ID SIAL_1HNMR_012803