RefMet Compound Details

RefMet IDRM0000476
MW structure49736 (View MW Metabolite Database details)
RefMet name2-Hydroxybenzyl alcohol
Systematic name2-(hydroxymethyl)phenol
SMILESc1ccc(c(c1)CO)O   Run Tanimoto similarity search (with similarity coefficient >=0.6)
Exact mass124.052430 (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
FormulaC7H8O2View other entries in RefMet with this formula
InChIInChI=1S/C7H8O2/c8-5-6-3-1-2-4-7(6)9/h1-4,8-9H,5H2
InChIKeyCQRYARSYNCAZFO-UHFFFAOYSA-NView other enantiomers/diastereomers of this metabolite in RefMet
Super ClassBenzenoids
Main ClassBenzenes
Sub ClassHydroxybenzoic acids
Pubchem CID5146
ChEBI ID16464
Annotation level1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)
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