2,3-Dihydroxybenzoic acid

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Systematic / IUPAC Name: 2,3-Dihydroxybenzoic acid

ID: Reference109

Other Names: Benzoic acid, 2,3-dihydroxy-;
2-3-Dihydroxybenzoate;
3-Carboxybenzene-1,2-diol, 3-carboxycatechol;
3-Hydroxysalicylic acid;
Benzoic acid, dihydroxy- ; more

Formula: C7H6O4

Class: Endogenous Metabolites

Spectral Data

2,3-Dihydroxybenzoic acid mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Elite
No. of Spectral Trees 2
No. of Spectra 249
Tandem Spectra MS1, MS2, MS3
Ionization Methods ESI
Analyzers FT
Last Modification 11/4/2014 1:47:21 PM
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Identificators

InChI InChI=1S/C7H6O4/c8-5-3-1-2-4(6(5)9)7(10)11/h1-3,8-9H,(H,10,11)
InChI Key GLDQAMYCGOIJDV-UHFFFAOYSA-N
Canonical SMILES c1cc(c(c(c1)O)O)C(=O)O
CAS 303388
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Other Names Benzoic acid, 2,3-dihydroxy-;
2-3-Dihydroxybenzoate;
3-Carboxybenzene-1,2-diol, 3-carboxycatechol;
3-Hydroxysalicylic acid;
Benzoic acid, dihydroxy-;
2,3 DHB;
2-Pyrocatechuic acid;
DHBA;
DOBK;
o-Pyrocatechuic acid;
Pyrocatechuic acid

In Other Databases

PubChem 19
ChemIDPlus 000303388; 000875285; 027138574; 052856549
Wikipedia 2,3-Dihydroxybenzoic acid
ChemSpider 18
ChEMBL CHEMBL1432
HMDb HMDB00397
ChEBI CHEBI:18026
KEGG C00196