5-Chlorosalicylic acid
1464
Reference
5-Chlorosalicylic acid Structure
Systematic / IUPAC Name: 5-Chloro-2-hydroxybenzoic acid
ID: Reference1464
Other Names:
Benzoic acid, 5-chloro-2-hydroxy-;
2-Hydroxy-5-chlorobenzoic acid;
Salicylic acid, 5-chloro-
Formula: C7H5ClO3
Spectral Data
5-Chlorosalicylic 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 | Q Exactive Orbitrap |
| No. of Spectral Trees | 2 |
| No. of Spectra | 112 |
| Tandem Spectra | MS1, MS2 |
| Ionization Methods | ESI |
| Analyzers | FT |
| Last Modification | 12/3/2014 11:17:12 AM |
Identificators
| InChI | InChI=1S/C7H5ClO3/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3,9H,(H,10,11) |
| InChI Key | NKBASRXWGAGQDP-UHFFFAOYSA-N |
| Canonical SMILES | C1=CC(=C(C=C1Cl)C(=O)O)O |
| CAS | 321142 |
| Splash | |
| Other Names |
Benzoic acid, 5-chloro-2-hydroxy-; 2-Hydroxy-5-chlorobenzoic acid; Salicylic acid, 5-chloro- |
In Other Databases
| ChEMBL | CHEMBL1375 |
| PubChem | 9447 |
| ChemSpider | 9075 |
| ChemIDPlus | 000321142; DG5062500 |
| ChEBI | CHEBI:420128 |