(E)-5,5-dimethyl-4-phenylsulfanyl-hex-2-enal

Systemtic Name: (E)-5,5-dimethyl-4-phenylsulfanyl-hex-2-enal Openeye Name: (E)-5,5-dimethyl-4-phenylsulfanyl-hex-2-enal CAS Name: (E)-5,5-dimethyl-4-(phenylthio)-2-hexenal IUPAC Name: (E)-5,5-dimethyl-4-phenylsulfanylhex-2-enal Traditional Name: (E)-5,5-dimethyl-4-(phenylthio)hex-2-enal Formula: C14H18OS MolecularWeight: 234.35712

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C=CC=O)SC1=CC=CC=C1

Isomeric SMILES

CC(C)(C)C(/C=C/C=O)SC1=CC=CC=C1

InChI

InChI=1S/C14H18OS/c1-14(2,3)13(10-7-11-15)16-12-8-5-4-6-9-12/h4-11,13H,1-3H3/b10-7+