1-(3,3-dimethylbut-1-ynyl)-4-(trifluoromethyl)benzene

Systemtic Name: 1-(3,3-dimethylbut-1-ynyl)-4-(trifluoromethyl)benzene Openeye Name: 1-(3,3-dimethylbut-1-ynyl)-4-(trifluoromethyl)benzene CAS Name: 1-(3,3-dimethylbut-1-ynyl)-4-(trifluoromethyl)benzene IUPAC Name: 1-(3,3-dimethylbut-1-ynyl)-4-(trifluoromethyl)benzene Traditional Name: 1-(3,3-dimethylbut-1-ynyl)-4-(trifluoromethyl)benzene Formula: C13H13F3 MolecularWeight: 226.23753

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C#CC1=CC=C(C=C1)C(F)(F)F

Isomeric SMILES

CC(C)(C)C#CC1=CC=C(C=C1)C(F)(F)F

InChI

InChI=1S/C13H13F3/c1-12(2,3)9-8-10-4-6-11(7-5-10)13(14,15)16/h4-7H,1-3H3