2,3,4-Trihydroxybenzoic acid
13774
Reference
2,3,4-Trihydroxybenzoic acid Structure
Systematic / IUPAC Name:
ID: Reference13774
Other Names: AA-3865
Formula: C7H6O5
Class: Endogenous Metabolites
Spectral Data
2,3,4-Trihydroxybenzoic acid mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Orbitrap ID-X with ETD_Cal Gateshead |
| No. of Spectral Trees | 1 |
| No. of Spectra | 463 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 2/19/2026 11:49:04 AM |
Identificators
| InChI | InChI=1S/C7H6O5/c8-4-2-1-3(7(11)12)5(9)6(4)10/h1-2,8-10H,(H,11,12) |
| InChI Key | BRRSNXCXLSVPFC-UHFFFAOYSA-N |
| Canonical SMILES | O=C(O)c1ccc(O)c(O)c1O |
| CAS | |
| Splash | |
| Other Names | AA-3865 |
In Other Databases
| ChemSpider | 11381 |
| PubChem | 11874; 11874 |
| HMDb | HMDB0059964; HMDB59964 |
| ChEBI | CHEBI:88714 |
| ChEMBL | CHEMBL220779 |