3,5,5-trimethyl-1-thiophen-2-yl-hexan-1-one

Systemtic Name: 3,5,5-trimethyl-1-thiophen-2-yl-hexan-1-one Openeye Name: 3,5,5-trimethyl-1-(2-thienyl)hexan-1-one CAS Name: 3,5,5-trimethyl-1-thiophen-2-yl-1-hexanone IUPAC Name: 3,5,5-trimethyl-1-thiophen-2-ylhexan-1-one Traditional Name: 3,5,5-trimethyl-1-(2-thienyl)hexan-1-one Formula: C13H20OS MolecularWeight: 224.3623

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)C1=CC=CS1)CC(C)(C)C

Isomeric SMILES

CC(CC(=O)C1=CC=CS1)CC(C)(C)C

InChI

InChI=1S/C13H20OS/c1-10(9-13(2,3)4)8-11(14)12-6-5-7-15-12/h5-7,10H,8-9H2,1-4H3