1,2,3-Benzenetriol

• Formula: C₆H₆O₃
• Molecular weight: 126.1100
• IUPAC Standard InChI: InChI=1S/C6H6O3/c7-4-2-1-3-5(8)6(4)9/h1-3,7-9H Copy

  
• IUPAC Standard InChIKey: WQGWDDDVZFFDIG-UHFFFAOYSA-N Copy
• CAS Registry Number: 87-66-1
• Chemical structure:
  This structure is also available as a 2d Mol file or as a computed 3d SD file
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• Other names: Pyrogallol; C.I. Oxidation Base 32; C.I. 76515; Fouramine Brown AP; Fourrine PG; Fourrine 85; Pyrogallic acid; 1,2,3-Trihydroxybenzene; Benzene, 1,2,3-trihydroxy-; 1,2,3-Trihydroxybenzen; 2,3-Dihydroxyphenol; Fouramine base ap; Piral; Pyro; Benzene-1,2,3-triol; NSC 5035; C.I. 76551; Phenol
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• Information on this page:
  • Mass spectrum (electron ionization)
  • UV/Visible spectrum
  • Gas Chromatography
  • References
  • Notes
• Other data available:
  • Gas phase thermochemistry data
  • Condensed phase thermochemistry data
  • Phase change data
  • IR Spectrum
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Mass spectrum (electron ionization)

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director

Spectrum

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Additional Data

UV/Visible spectrum

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled by: Victor Talrose, Eugeny B. Stern, Antonina A. Goncharova, Natalia A. Messineva, Natalia V. Trusova, Margarita V. Efimkina

Spectrum

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Additional Data

Gas Chromatography

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director

Van Den Dool and Kratz RI, non-polar column, custom temperature program

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Normal alkane RI, non-polar column, temperature ramp

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References

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Bernauer, 1954
Bernauer, K., Zusammenhange zwischen konstitution, sterischen verhaltnissen und ultraviolett-spektren bei derivaten des brevifolins, Justus Liebigs Ann. Chem., 1954, 588, 230-238. [all data]

Tret'yakov, 2008
Tret'yakov, K.V., Retention Data. NIST Mass Spectrometry Data Center., NIST Mass Spectrometry Data Center, 2008. [all data]

Park, Lee, et al., 2004
Park, B.-S.; Lee, K.-G.; Takeoka, G.R., Comparison of three sample preparation methods on the recovery of volatiles from taheebo (Tabebuia impetiginosa Martius ex DC), Flavour Fragr. J., 2004, 19, 4, 287-292, https://doi.org/10.1002/ffj.1345 . [all data]

Notes

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• Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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