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Hydroquinone
SpectraBase Compound ID 4Xuigk2ZXzz
InChI InChI=1S/C6H6O2/c7-5-1-2-6(8)4-3-5/h1-4,7-8H
InChIKey QIGBRXMKCJKVMJ-UHFFFAOYSA-N
Mol Weight 110.11 g/mol
Molecular Formula C6H6O2
Exact Mass 110.036779 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5xD8vno3LKK
Name Hydroquinone
Acquisition Mode SIMULTANEOUS
CAS Registry Number 8027-02-9 57534-13-1 123-31-9
ChEBI ID 17594
Comments 100 mM Hydroquinone - Sigma H-9003; 100 % D2O 50 mM sodium phosphate 500 uM sodium azide 500 uM DSS - pH 7.4, temperature 298 K
Copyright Database Compilation Copyright © 2021-2024 John Wiley & Sons, Inc. All Rights Reserved.
Data Source Madison Metabolomics Consortium - Qiu Cui, Ian Lewis, Brendan Hodis, Mark E. Anderson, John L. Markley
Formula C6 H6 O2
IUPAC Name benzene-1,4-diol; hydroquinone
InChI InChI=1S/C6H6O2/c7-5-1-2-6(8)4-3-5/h1-4,7-8H
InChIKey QIGBRXMKCJKVMJ-UHFFFAOYSA-N
KEGG Compound ID C00530
KEGG Pathways PATH: map00350 Tyrosine metabolism PATH: map00361 gamma-Hexachlorocyclohexane degradation PATH: map00363 Bisphenol A degradation PATH: map00740 Riboflavin metabolism
PubChem Compound ID 785
SMILES C1=CC(=CC=C1O)O
Source File Reference bmse000293