prop-2-ynyl 3,5,5-trimethylhexanoate

Systemtic Name: prop-2-ynyl 3,5,5-trimethylhexanoate Openeye Name: prop-2-ynyl 3,5,5-trimethylhexanoate CAS Name: 3,5,5-trimethylhexanoic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl 3,5,5-trimethylhexanoate Traditional Name: 3,5,5-trimethylhexanoic acid propargyl ester Formula: C12H20O2 MolecularWeight: 196.286

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OCC#C)CC(C)(C)C

Isomeric SMILES

CC(CC(=O)OCC#C)CC(C)(C)C

InChI

InChI=1S/C12H20O2/c1-6-7-14-11(13)8-10(2)9-12(3,4)5/h1,10H,7-9H2,2-5H3