RefMet Compound Details

MW structure41494 (View MW Metabolite Database details)
RefMet name4-Hydroxybenzaldehyde
Systematic name4-hydroxybenzaldehyde
SMILESc1cc(ccc1C=O)O   Run Tanimoto similarity search (with similarity coefficient >=0.6)
Exact mass122.036780 (neutral)
Calculate m/z:   
View other RefMet entries with this exact (neutral) mass:   +/- 0.05 amu   +/- 0.1 amu   +/- 0.2 amu   +/- 0.5 amu
FormulaC7H6O2View other entries in RefMet with this formula
InChIKeyRGHHSNMVTDWUBI-UHFFFAOYSA-NView other enantiomers/diastereomers of this metabolite in RefMet
Super ClassPolyketides
Main ClassPhenolic acids
Sub ClassPhenolic acids
Pubchem CID126
Annotation level1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)