butanoate; 2-(3-methylbutyl)furan

Systemtic Name: butanoate; 2-(3-methylbutyl)furan Openeye Name: butanoate; 2-isopentylfuran CAS Name: butanoate; 2-(3-methylbutyl)furan IUPAC Name: butanoate; 2-(3-methylbutyl)furan Traditional Name: butyrate; 2-isoamylfuran Formula: C13H21O3- MolecularWeight: 225.30404

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)[O-].CC(C)CCC1=CC=CO1

Isomeric SMILES

CCCC(=O)[O-].CC(C)CCC1=CC=CO1

InChI

InChI=1S/C9H14O.C4H8O2/c1-8(2)5-6-9-4-3-7-10-9;1-2-3-4(5)6/h3-4,7-8H,5-6H2,1-2H3;2-3H2,1H3,(H,5,6)/p-1