3-methylbutyl oct-2-ynoate

Systemtic Name: 3-methylbutyl oct-2-ynoate Openeye Name: isopentyl oct-2-ynoate CAS Name: 2-octynoic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl oct-2-ynoate Traditional Name: oct-2-ynoic acid isoamyl ester Formula: C13H22O2 MolecularWeight: 210.31258

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC#CC(=O)OCCC(C)C

Isomeric SMILES

CCCCCC#CC(=O)OCCC(C)C

InChI

InChI=1S/C13H22O2/c1-4-5-6-7-8-9-13(14)15-11-10-12(2)3/h12H,4-7,10-11H2,1-3H3