Met001600: butamben
Metabolite Information
Name
butamben
IUPAC Name
butyl 4-aminobenzoate
Molecular Formula
C11H15NO2
Molecular Weight
193.24
Exact Mass
193.1102787
SMILES
CCCCOC(=O)C1=CC=C(C=C1)N
InChIKey
IUWVALYLNVXWKX-UHFFFAOYSA-N
InChI
InChI=1S/C11H15NO2/c1-2-3-8-14-11(13)9-4-6-10(12)7-5-9/h4-7H,2-3,8,12H2,1H3
Other Databases Link
Structure
2D Structure
3D Structure
Classification
(data sourced from ClassyFire)
Kingdom:
Organic compounds
Superclass:
Benzenoids
Class:
Benzene and substituted derivatives
Subclass:
Benzoic acids and derivatives
Crops containing this metabolite
sugar_maple
Metabolite Spectrum Accession Label