| SpectraBase Spectrum ID |
FrTo5UcMW4Z |
| Name |
p-Anisic acid |
| Acquisition Mode |
SIMULTANEOUS |
| CAS Registry Number |
100-09-4; 1335-08-6 |
| ChEBI ID |
40813 |
| Comments |
100 mM p-Anisic_acid - Sigma-Aldrich; Solvent D2O; Buffer sodium phosphate; Cytocide sodium azide; Reference DS; 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 |
C8 H8 O3 |
| IUPAC Name |
4-methoxybenzoic acid |
| InChI |
InChI=1S/C8H8O3/c1-11-7-4-2-6(3-5-7)8(9)10/h2-5H,1H3,(H,9,10) |
| InChIKey |
ZEYHEAKUIGZSGI-UHFFFAOYSA-N |
| KEGG Compound ID |
C02519 |
| KEGG Pathways |
PATH: ko00623 2,4-Dichlorobenzoate degradation |
| PubChem Compound ID |
7478 |
| SMILES |
COC1=CC=C(C=C1)C(=O)O |
| Source File Reference |
bmse000356 |
