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Aurintricarboxylic acid
SpectraBase Compound ID A8AvcBTDcqT
InChI InChI=1S/C22H14O9/c23-16-4-1-10(7-13(16)20(26)27)19(11-2-5-17(24)14(8-11)21(28)29)12-3-6-18(25)15(9-12)22(30)31/h1-9,23-24H,(H,26,27)(H,28,29)(H,30,31)
InChIKey GIXWDMTZECRIJT-UHFFFAOYSA-N
Mol Weight 422.35 g/mol
Molecular Formula C22H14O9
Exact Mass 422.063782 g/mol
Copyright Copyright © 2012-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Eastman Chemical Company
Source of Spectrum Forensic Spectral Research
Copyright Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Alfa Aesar, Thermo Fisher Scientific
Source of Spectrum Bio-Rad Laboratories, Inc.
Catalog Number A15905
Copyright Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Aldrich
Catalog Number 123269
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Technique KBr WAFER
Copyright Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Alfa Aesar, Thermo Fisher Scientific
Source of Spectrum Bio-Rad Laboratories, Inc.
Catalog Number A15905
Technique KBr1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6
  • 5,5'-((3-Carboxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylene)bis(2-hydroxybenzoic acid)
  • COMPONENT-#A-13
  • 3-[BIS(3-CARBOXY-4-HYDROXYPHENYL)METHYLENE]-6-OXO-1,4-CYCLOHEXADIENE-1-CARBOXYLIC ACID
  • AURINITRICARBOXYLIC ACID
  • 5-[(3-CARBOXY-4-HYDROXYPHENYL)(3-CARBOXY-4-OXO-2,5-CYCLOHEXADIEN-1-YLIDENE)METHYL]-2-HYDROXYBENZOIC ACID
  • 1,4-CYCLOHEXADIENE-1-CARBOXYLIC ACID, 3-/BIS/3-CARBOXY-4-HYDROXYPHENYL/- METHYLENE/-6-OXO-,
  • Ata
Title Journal or Book Year
Isolation and structure elucidation of low molecular weight components of aurintricarboxylic acid (ATA) The Journal of Organic Chemistry 1992

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