1-methyl-4-prop-1-ynyl-3,5,8-trioxabicyclo[2.2.2]octane

Systemtic Name: 1-methyl-4-prop-1-ynyl-3,5,8-trioxabicyclo[2.2.2]octane Openeye Name: 1-methyl-4-prop-1-ynyl-3,5,8-trioxabicyclo[2.2.2]octane CAS Name: 1-methyl-4-prop-1-ynyl-3,5,8-trioxabicyclo[2.2.2]octane IUPAC Name: 1-methyl-4-prop-1-ynyl-3,5,8-trioxabicyclo[2.2.2]octane Traditional Name: 1-methyl-4-prop-1-ynyl-3,5,8-trioxabicyclo[2.2.2]octane Formula: C9H12O3 MolecularWeight: 168.18978

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC12OCC(CO1)(CO2)C

Isomeric SMILES

CC#CC12OCC(CO1)(CO2)C

InChI

InChI=1S/C9H12O3/c1-3-4-9-10-5-8(2,6-11-9)7-12-9/h5-7H2,1-2H3