| SpectraBase Spectrum ID |
KkiXpwQacMX |
| Name |
4-Aminophenol |
| Acquisition Mode |
SIMULTANEOUS |
| CAS Registry Number |
63084-98-0; 52985-09-8; 51-78-5 |
| ChEBI ID |
17602 |
| Comments |
Saturated 4-Aminophenol - Sigma-Aldrich; Solvent D2O; Buffer sodium phosphate; Cytocide sodium azide; Reference DSS; pH 7.4, temperature 298 K |
| Copyright |
Database Compilation Copyright © 2021-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Data Source |
Madison Metabolomics Consortium |
| Formula |
C6 H7 N O |
| IUPAC Name |
4-aminophenol |
| InChI |
InChI=1S/C6H7NO/c7-5-1-3-6(8)4-2-5/h1-4,8H,7H2 |
| InChIKey |
PLIKAWJENQZMHA-UHFFFAOYSA-N |
| KEGG Compound ID |
C02372 |
| KEGG Pathways |
PATH: ko00361 gamma-Hexachlorocyclohexane degradation
PATH: ko00623 2,4-Dichlorobenzoate degradation |
| PubChem Compound ID |
403 |
| SMILES |
C1=CC(=CC=C1N)O |
| Source File Reference |
bmse000462 |
