RefMet Compound Details

MW structure51159 (View MW Metabolite Database details)
RefMet name2-Aminophenol
Systematic name2-aminophenol
SMILESNc1ccccc1O
Sum Composition2-Aminophenol View other entries in RefMet with this sum composition
Exact mass109.052764 (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
FormulaC6H7NOView other entries in RefMet with this formula
InChIInChI=1S/C6H7NO/c7-5-3-1-2-4-6(5)8/h1-4,8H,7H2
InChIKeyCDAWCLOXVUBKRW-UHFFFAOYSA-NView other enantiomers/diastereomers of this metabolite in RefMet
Super ClassBenzenoids
Main ClassPhenols
Sub ClassAminophenols
Pubchem CID5801
Annotation level1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)
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